[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-methylquinoline-4-carboxylate
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![[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-methylquinoline-4-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/26ff5f5910fe4201bc07ad807e0d9006.png "[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-methylquinoline-4-carboxylate")
[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-methylquinoline-4-carboxylate
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CAS No:
731789-88-1
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Formula:
C22H21N3O4S
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Chemical Name:
[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-methylquinoline-4-carboxylate
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Synonyms:
ZINC3365250;AKOS033508530;MCULE-5979572410;Z16535930;[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]methyl 2-methylquinoline-4-carboxylate;731789-88-1
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CAS No:
[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-methylquinoline-4-carboxylate Basic Attributes
423.5 g/mol
423.12527733 g/mol
Computed Properties
Molecular Weight:423.5
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:423.12527733
Monoisotopic Mass:423.12527733
Topological Polar Surface Area:140
Heavy Atom Count:30
Complexity:675
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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