[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate
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![[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c91407a1688c43e096f5ce2e6bf54a4b.png "[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate")
[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate
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CAS No:
731840-51-0
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Formula:
C19H18N2O6S
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Chemical Name:
[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate
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Synonyms:
ZINC3309307;AKOS033612155;MCULE-5478633759;Z18362103;[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]methyl 2H-1,3-benzodioxole-5-carboxylate;731840-51-0
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CAS No:
[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate Basic Attributes
402.4 g/mol
402.08855747 g/mol
Computed Properties
Molecular Weight:402.4
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:402.08855747
Monoisotopic Mass:402.08855747
Topological Polar Surface Area:145
Heavy Atom Count:28
Complexity:632
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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