[2-(5-chloro-2-cyanoanilino)-2-oxoethyl] (2S)-4-amino-2-[(4-chlorobenzoyl)amino]-4-oxobutanoate
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[2-(5-chloro-2-cyanoanilino)-2-oxoethyl] (2S)-4-amino-2-[(4-chlorobenzoyl)amino]-4-oxobutanoate
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CAS No:
956746-28-4
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Formula:
C20H16Cl2N4O5
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Chemical Name:
[2-(5-chloro-2-cyanoanilino)-2-oxoethyl] (2S)-4-amino-2-[(4-chlorobenzoyl)amino]-4-oxobutanoate
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Synonyms:
ZINC3309211;AKOS034826391;MCULE-4874165313;AB00718762-01;Z56905139;[(5-chloro-2-cyanophenyl)carbamoyl]methyl (2S)-3-carbamoyl-2-[(4-chlorophenyl)formamido]propanoate;956746-28-4
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CAS No:
[2-(5-chloro-2-cyanoanilino)-2-oxoethyl] (2S)-4-amino-2-[(4-chlorobenzoyl)amino]-4-oxobutanoate Basic Attributes
463.3 g/mol
462.0497750 g/mol
Computed Properties
Molecular Weight:463.3
XLogP3:2.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:462.0497750
Monoisotopic Mass:462.0497750
Topological Polar Surface Area:151
Heavy Atom Count:31
Complexity:732
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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