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emSynthesis
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emical database
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Chemical Name
Cas Number
EINECS Number
MDL Number
Molecular Formula
InChIKey
Smiles
Journal Title
GO
Journal of Medicinal Chemistry - 1163 compounds - page 8
3-methyl-1H-quinoxalin-2-one
Molecular Formula:
C
9
H
8
N
2
O
Molecular Weight:
160.175 g/mol
Cas Number:
14003-34-0
EINECS Number:
-
1,3-dimethyl-1H-quinoxalin-2-one
Molecular Formula:
C
10
H
10
N
2
O
Molecular Weight:
174.202 g/mol
Cas Number:
3149-25-5
EINECS Number:
-
4-chloro-5-methoxy-3-quinolinecarbonitrile
Molecular Formula:
C
11
H
7
ClN
2
O
Molecular Weight:
218.642 g/mol
Cas Number:
-
EINECS Number:
-
4-chloro-5,7-dimethoxy-3-quinolinecarbonitrile
Molecular Formula:
C
12
H
9
ClN
2
O
2
Molecular Weight:
248.668 g/mol
Cas Number:
-
EINECS Number:
-
4-hydroxy-5-methoxy-3-quinolinecarbonitrile
Molecular Formula:
C
11
H
8
N
2
O
2
Molecular Weight:
200.197 g/mol
Cas Number:
331662-64-7
EINECS Number:
-
4-hydroxy-5,7-dimethoxy-3-quinolinecarbonitrile
Molecular Formula:
C
12
H
10
N
2
O
3
Molecular Weight:
230.223 g/mol
Cas Number:
-
EINECS Number:
-
dimethyl 2,3-dimethoxyterephthalate
Molecular Formula:
C
12
H
14
O
6
Molecular Weight:
254.24 g/mol
Cas Number:
-
EINECS Number:
-
2,3-dimethoxyterephthalaldehyde
Molecular Formula:
C
10
H
10
O
4
Molecular Weight:
194.187 g/mol
Cas Number:
-
EINECS Number:
-
4-(4-fluoro-1,3-benzothiazol-2-yl)phenylamine
Molecular Formula:
C
13
H
9
FN
2
S
Molecular Weight:
244.292 g/mol
Cas Number:
-
EINECS Number:
-
4-(5-fluoro-1,3-benzothiazol-2-yl)phenylamine
Molecular Formula:
C
13
H
9
FN
2
S
Molecular Weight:
244.292 g/mol
Cas Number:
-
EINECS Number:
-
5-chloro-2-quinoxalinol
Molecular Formula:
C
8
H
5
ClN
2
O
Molecular Weight:
180.593 g/mol
Cas Number:
-
EINECS Number:
-
2,5-dichloroquinoxaline
Molecular Formula:
C
8
H
4
Cl
2
N
2
Molecular Weight:
199.039 g/mol
Cas Number:
-
EINECS Number:
-
8-chloro-2-quinoxalinol
Molecular Formula:
C
8
H
5
ClN
2
O
Molecular Weight:
180.593 g/mol
Cas Number:
-
EINECS Number:
-
2,8-dichloroquinoxaline
Molecular Formula:
C
8
H
4
Cl
2
N
2
Molecular Weight:
199.039 g/mol
Cas Number:
-
EINECS Number:
-
2-chloro-7-methylquinoxaline
Molecular Formula:
C
9
H
7
ClN
2
Molecular Weight:
178.621 g/mol
Cas Number:
-
EINECS Number:
-
2-chloro-7-methoxyquinoxaline
Molecular Formula:
C
9
H
7
ClN
2
O
Molecular Weight:
194.62 g/mol
Cas Number:
-
EINECS Number:
-
7-iodo-2-quinoxalinol
Molecular Formula:
C
8
H
5
IN
2
O
Molecular Weight:
272.045 g/mol
Cas Number:
-
EINECS Number:
-
2-chloro-7-iodoquinoxaline
Molecular Formula:
C
8
H
4
ClIN
2
Molecular Weight:
290.49 g/mol
Cas Number:
-
EINECS Number:
-
2-chloro-6-nitroquinoxaline
Molecular Formula:
C
8
H
4
ClN
3
O
2
Molecular Weight:
209.591 g/mol
Cas Number:
6272-25-9
EINECS Number:
-
7-chloro-8-methoxy-2-quinoxalinol
Molecular Formula:
C
9
H
7
ClN
2
O
2
Molecular Weight:
210.62 g/mol
Cas Number:
-
EINECS Number:
-
2-(4-hydroxyphenoxy)propanenitrile
Molecular Formula:
C
9
H
9
NO
2
Molecular Weight:
163.176 g/mol
Cas Number:
343866-65-9
EINECS Number:
-
2-amino-6-chloro-3,5-pyridinedicarbonitrile
Molecular Formula:
C
7
H
3
ClN
4
Molecular Weight:
178.58 g/mol
Cas Number:
51768-01-5
EINECS Number:
-
6-iodo-2,4-quinazolinediamine
Molecular Formula:
C
8
H
7
IN
4
Molecular Weight:
286.075 g/mol
Cas Number:
132131-20-5
EINECS Number:
-
ethyl 4-amino-5-fluoro-2-methyl-3-quinolinecarboxylate
Molecular Formula:
C
13
H
13
FN
2
O
2
Molecular Weight:
248.257 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 4-amino-2-methyl-3-quinolinecarboxylate
Molecular Formula:
C
13
H
14
N
2
O
2
Molecular Weight:
230.266 g/mol
Cas Number:
-
EINECS Number:
-
(4-amino-2-methyl-3-quinolinyl)methanol
Molecular Formula:
C
11
H
12
N
2
O
Molecular Weight:
188.229 g/mol
Cas Number:
-
EINECS Number:
-
(4-amino-5-chloro-2-methyl-3-quinolinyl)methanol
Molecular Formula:
C
11
H
11
ClN
2
O
Molecular Weight:
222.674 g/mol
Cas Number:
-
EINECS Number:
-
5-bromo-1,1,1-trifluoro-2-pentanone
Molecular Formula:
C
5
H
6
BrF
3
O
Molecular Weight:
219 g/mol
Cas Number:
-
EINECS Number:
-
2,2,2-trifluoro-1-(3-methylphenyl)ethanone
Molecular Formula:
C
9
H
7
F
3
O
Molecular Weight:
188.149 g/mol
Cas Number:
1736-06-7
EINECS Number:
-
1-[3-(bromomethyl)phenyl]-2,2,2-trifluoroethanone
Molecular Formula:
C
9
H
6
BrF
3
O
Molecular Weight:
267.045 g/mol
Cas Number:
-
EINECS Number:
-
4-bromo-5,8-dimethoxyquinoline
Molecular Formula:
C
11
H
10
BrNO
2
Molecular Weight:
268.11 g/mol
Cas Number:
-
EINECS Number:
-
5,8-dimethoxy-4-nitroquinoline
Molecular Formula:
C
11
H
10
N
2
O
4
Molecular Weight:
234.211 g/mol
Cas Number:
-
EINECS Number:
-
4-nitro-5,8-quinolinedione
Molecular Formula:
C
9
H
4
N
2
O
4
Molecular Weight:
204.142 g/mol
Cas Number:
-
EINECS Number:
-
5,8-dimethoxy-4-quinolinamine
Molecular Formula:
C
11
H
12
N
2
O
2
Molecular Weight:
204.229 g/mol
Cas Number:
-
EINECS Number:
-
methyl 3-ethyl-4-fluorobenzoate
Molecular Formula:
C
10
H
11
FO
2
Molecular Weight:
182.195 g/mol
Cas Number:
-
EINECS Number:
-
(3-ethyl-4-fluorophenyl)methanol
Molecular Formula:
C
9
H
11
FO
Molecular Weight:
154.184 g/mol
Cas Number:
-
EINECS Number:
-
3-ethyl-4-fluorobenzaldehyde
Molecular Formula:
C
9
H
9
FO
Molecular Weight:
152.168 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 5-oxopentanoate
Molecular Formula:
C
7
H
12
O
3
Molecular Weight:
144.17 g/mol
Cas Number:
-
EINECS Number:
-
propyl 5-oxopentanoate
Molecular Formula:
C
8
H
14
O
3
Molecular Weight:
158.197 g/mol
Cas Number:
-
EINECS Number:
-
5-oxo-5-piperidin-1-ylpentanal
Molecular Formula:
C
10
H
17
NO
2
Molecular Weight:
183.251 g/mol
Cas Number:
-
EINECS Number:
-
5,5-dimethoxypentanoic acid
Molecular Formula:
C
7
H
14
O
4
Molecular Weight:
162.186 g/mol
Cas Number:
-
EINECS Number:
-
6-(2-furyl)-1H-purine
Molecular Formula:
C
9
H
6
N
4
O
Molecular Weight:
186.173 g/mol
Cas Number:
-
EINECS Number:
-
6-(2-furyl)-9-methyl-9H-purine
Molecular Formula:
C
10
H
8
N
4
O
Molecular Weight:
200.2 g/mol
Cas Number:
-
EINECS Number:
-
4-(hexyloxy)aniline
Molecular Formula:
C
12
H
19
NO
Molecular Weight:
193.289 g/mol
Cas Number:
39905-57-2
EINECS Number:
254-696-8
4-(cyclohexyloxy)aniline
Molecular Formula:
C
12
H
17
NO
Molecular Weight:
191.273 g/mol
Cas Number:
-
EINECS Number:
-
(3-phenyl-phenyl)-amine
Molecular Formula:
C
12
H
11
N
Molecular Weight:
169.226 g/mol
Cas Number:
2243-47-2
EINECS Number:
-
2,4-quinolinedicarboxylic acid
Molecular Formula:
C
11
H
7
NO
4
Molecular Weight:
217.181 g/mol
Cas Number:
5323-57-9
EINECS Number:
-
6-hydroxy-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
11
H
7
NO
5
Molecular Weight:
233.18 g/mol
Cas Number:
-
EINECS Number:
-
8-hydroxy-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
11
H
7
NO
5
Molecular Weight:
233.18 g/mol
Cas Number:
-
EINECS Number:
-
6-methoxy-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
12
H
9
NO
5
Molecular Weight:
247.207 g/mol
Cas Number:
-
EINECS Number:
-
6-hexoxy-quinoline-2,4-dicarboxylic acid
Molecular Formula:
C
17
H
19
NO
5
Molecular Weight:
317.34 g/mol
Cas Number:
-
EINECS Number:
-
6-cyclohexyloxy-quinoline-2,4-dicarboxylic acid
Molecular Formula:
C
17
H
17
NO
5
Molecular Weight:
315.326 g/mol
Cas Number:
-
EINECS Number:
-
6-phenoxy-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
17
H
11
NO
5
Molecular Weight:
309.278 g/mol
Cas Number:
-
EINECS Number:
-
5,8-dimethoxy-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
13
H
11
NO
6
Molecular Weight:
277.233 g/mol
Cas Number:
-
EINECS Number:
-
2,4,8-quinolinetricarboxylic acid
Molecular Formula:
C
12
H
7
NO
6
Molecular Weight:
261.191 g/mol
Cas Number:
-
EINECS Number:
-
6-phenyl-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
17
H
11
NO
4
Molecular Weight:
293.279 g/mol
Cas Number:
-
EINECS Number:
-
8-fluoro-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
11
H
6
FNO
4
Molecular Weight:
235.171 g/mol
Cas Number:
-
EINECS Number:
-
6-chloro-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
11
H
6
ClNO
4
Molecular Weight:
251.626 g/mol
Cas Number:
-
EINECS Number:
-
7,8-dichloro-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
11
H
5
Cl
2
NO
4
Molecular Weight:
286.07 g/mol
Cas Number:
-
EINECS Number:
-
5-bromo-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
11
H
6
BrNO
4
Molecular Weight:
296.077 g/mol
Cas Number:
-
EINECS Number:
-
5-iodo-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
11
H
6
INO
4
Molecular Weight:
343.08 g/mol
Cas Number:
-
EINECS Number:
-
4-ethyl-5-piperidin-4-yl-isoxazol-3-ol
Molecular Formula:
C
10
H
16
N
2
O
2
Molecular Weight:
196.249 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 2,6-dichloroisonicotinate
Molecular Formula:
C
8
H
7
Cl
2
NO
2
Molecular Weight:
220.055 g/mol
Cas Number:
1604-14-4
EINECS Number:
-
4,6-difluoro-1-indanone
Molecular Formula:
C
9
H
6
F
2
O
Molecular Weight:
168.143 g/mol
Cas Number:
162548-73-4
EINECS Number:
-
6-amino-1-indanone
Molecular Formula:
C
9
H
9
NO
Molecular Weight:
147.177 g/mol
Cas Number:
69975-65-1
EINECS Number:
-
ethyl 2-ethoxy-6-methylaminopyridine-3-carboxylate
Molecular Formula:
C
11
H
16
N
2
O
3
Molecular Weight:
224.26 g/mol
Cas Number:
-
EINECS Number:
-
methyl 2-chloro-6-methoxynicotinate
Molecular Formula:
C
8
H
8
ClNO
3
Molecular Weight:
201.609 g/mol
Cas Number:
95652-77-0
EINECS Number:
-
2-chloro-6-methoxynicotinic acid
Molecular Formula:
C
7
H
6
ClNO
3
Molecular Weight:
187.582 g/mol
Cas Number:
503000-87-1
EINECS Number:
-
2-hydroxy-2-phenylpropanenitrile
Molecular Formula:
C
9
H
9
NO
Molecular Weight:
147.177 g/mol
Cas Number:
-
EINECS Number:
-
2-hydroxy-2-phenylpropanamide
Molecular Formula:
C
9
H
11
NO
2
Molecular Weight:
165.192 g/mol
Cas Number:
2019-68-3
EINECS Number:
-
3,3,3-trifluoro-2-hydroxy-2-phenylpropanoic acid
Molecular Formula:
C
9
H
7
F
3
O
3
Molecular Weight:
220.148 g/mol
Cas Number:
-
EINECS Number:
-
7-chloro-4-iodoquinoline
Molecular Formula:
C
9
H
5
ClIN
Molecular Weight:
289.503 g/mol
Cas Number:
98591-57-2
EINECS Number:
-
5-diethylamino-pentan-2-one
Molecular Formula:
C
9
H
19
NO
Molecular Weight:
157.256 g/mol
Cas Number:
105-14-6
EINECS Number:
203-274-1
4-(3-hydroxypropoxy)benzaldehyde
Molecular Formula:
C
10
H
12
O
3
Molecular Weight:
180.203 g/mol
Cas Number:
99186-35-3
EINECS Number:
-
3-ethoxy-4-(3-hydroxypropoxy)benzaldehyde
Molecular Formula:
C
12
H
16
O
4
Molecular Weight:
224.257 g/mol
Cas Number:
-
EINECS Number:
-
3-phenoxy-1-propanol
Molecular Formula:
C
9
H
12
O
2
Molecular Weight:
152.193 g/mol
Cas Number:
6180-61-6
EINECS Number:
228-228-8
1-methoxy-2-phenoxybenzene
Molecular Formula:
C
13
H
12
O
2
Molecular Weight:
200.237 g/mol
Cas Number:
1695-04-1
EINECS Number:
-
2-phenoxyphenol
Molecular Formula:
C
12
H
10
O
2
Molecular Weight:
186.21 g/mol
Cas Number:
2417-10-9
EINECS Number:
-
5-chloro-2-phenoxyphenol
Molecular Formula:
C
12
H
9
ClO
2
Molecular Weight:
220.655 g/mol
Cas Number:
-
EINECS Number:
-
4-fluoro-2-methoxy-1-phenoxybenzene
Molecular Formula:
C
13
H
11
FO
2
Molecular Weight:
218.228 g/mol
Cas Number:
-
EINECS Number:
-
5-fluoro-2-phenoxyphenol
Molecular Formula:
C
12
H
9
FO
2
Molecular Weight:
204.201 g/mol
Cas Number:
-
EINECS Number:
-
5-methyl-2-phenoxyphenol
Molecular Formula:
C
13
H
12
O
2
Molecular Weight:
200.237 g/mol
Cas Number:
-
EINECS Number:
-
6-bromo-5-nitro-1H-indole-2,3-dione
Molecular Formula:
C
8
H
3
BrN
2
O
4
Molecular Weight:
271.027 g/mol
Cas Number:
-
EINECS Number:
-
6-bromo-1-methyl-1H-indole-2,3-dione
Molecular Formula:
C
9
H
6
BrNO
2
Molecular Weight:
240.056 g/mol
Cas Number:
-
EINECS Number:
-
1-methyl-1H-indole-2,3-dione
Molecular Formula:
C
9
H
7
NO
2
Molecular Weight:
161.16 g/mol
Cas Number:
2058-74-4
EINECS Number:
218-164-9
4-(2-fluorobenzyl)piperidine
Molecular Formula:
C
12
H
16
FN
Molecular Weight:
193.264 g/mol
Cas Number:
194288-97-6
EINECS Number:
-
2,6-dichloro-4-methoxyaniline
Molecular Formula:
C
7
H
7
Cl
2
NO
Molecular Weight:
192.044 g/mol
Cas Number:
-
EINECS Number:
-
4-chloro-2,6-diphenylpyrimidine
Molecular Formula:
C
16
H
11
ClN
2
Molecular Weight:
266.73 g/mol
Cas Number:
29509-91-9
EINECS Number:
-
2,6-diphenyl-4-pyrimidinol
Molecular Formula:
C
16
H
12
N
2
O
Molecular Weight:
248.284 g/mol
Cas Number:
-
EINECS Number:
-
2,6-diphenyl-4-pyrimidinamine
Molecular Formula:
C
16
H
13
N
3
Molecular Weight:
247.299 g/mol
Cas Number:
-
EINECS Number:
-
4,6-diphenyl-2-pyrimidinamine
Molecular Formula:
C
16
H
13
N
3
Molecular Weight:
247.299 g/mol
Cas Number:
-
EINECS Number:
-
1-bromo-7-(bromomethyl)naphthalene
Molecular Formula:
C
11
H
8
Br
2
Molecular Weight:
299.993 g/mol
Cas Number:
-
EINECS Number:
-
8-bromo-2-naphthaldehyde
Molecular Formula:
C
11
H
7
BrO
Molecular Weight:
235.08 g/mol
Cas Number:
-
EINECS Number:
-
2-bromo-7-methylnaphthalene
Molecular Formula:
C
11
H
9
Br
Molecular Weight:
221.096 g/mol
Cas Number:
-
EINECS Number:
-
1-bromo-6-methylnaphthalene
Molecular Formula:
C
11
H
9
Br
Molecular Weight:
221.096 g/mol
Cas Number:
-
EINECS Number:
-
2-bromo-7-(bromomethyl)naphthalene
Molecular Formula:
C
11
H
8
Br
2
Molecular Weight:
299.993 g/mol
Cas Number:
-
EINECS Number:
-
7-bromo-2-naphthaldehyde
Molecular Formula:
C
11
H
7
BrO
Molecular Weight:
235.08 g/mol
Cas Number:
-
EINECS Number:
-
1-bromo-6-(bromomethyl)naphthalene
Molecular Formula:
C
11
H
8
Br
2
Molecular Weight:
299.993 g/mol
Cas Number:
-
EINECS Number:
-
5-bromo-2-naphthaldehyde
Molecular Formula:
C
11
H
7
BrO
Molecular Weight:
235.08 g/mol
Cas Number:
122349-66-0
EINECS Number:
-
1-fluoro-2-methylnaphthalene
Molecular Formula:
C
11
H
9
F
Molecular Weight:
160.191 g/mol
Cas Number:
573-99-9
EINECS Number:
-
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