[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 4-oxo-4-thiophen-2-ylbutanoate
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[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 4-oxo-4-thiophen-2-ylbutanoate
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CAS No:
730253-71-1
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Formula:
C19H18N2O4S2
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Chemical Name:
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 4-oxo-4-thiophen-2-ylbutanoate
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Synonyms:
ZINC3297307;AKOS033701586;MCULE-5274727652;Z19708576;[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]methyl 4-oxo-4-(thiophen-2-yl)butanoate;730253-71-1
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CAS No:
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 4-oxo-4-thiophen-2-ylbutanoate Basic Attributes
402.5 g/mol
402.07079941 g/mol
Computed Properties
Molecular Weight:402.5
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:402.07079941
Monoisotopic Mass:402.07079941
Topological Polar Surface Area:153
Heavy Atom Count:27
Complexity:632
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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