[2-(2-cyanoanilino)-2-oxoethyl] (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate
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[2-(2-cyanoanilino)-2-oxoethyl] (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate
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CAS No:
956984-80-8
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Formula:
C19H19N3O5S
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Chemical Name:
[2-(2-cyanoanilino)-2-oxoethyl] (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate
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Synonyms:
ZINC3339082;AKOS034826491;MCULE-6433717910;Z56929234;[(2-cyanophenyl)carbamoyl]methyl (2S)-2-(4-methylbenzenesulfonamido)propanoate;956984-80-8
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CAS No:
[2-(2-cyanoanilino)-2-oxoethyl] (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate Basic Attributes
401.4 g/mol
401.10454189 g/mol
Computed Properties
Molecular Weight:401.4
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:401.10454189
Monoisotopic Mass:401.10454189
Topological Polar Surface Area:134
Heavy Atom Count:28
Complexity:701
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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