 Home > Encyclopedia > [3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] (2S,3S)-2-[(4-chlorobenzoyl)amino]-3-methylpentanoate

[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] (2S,3S)-2-[(4-chlorobenzoyl)amino]-3-methylpentanoate

[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] (2S,3S)-2-[(4-chlorobenzoyl)amino]-3-methylpentanoate structure

CAS No:
956376-31-1
Formula:
C24H23ClN4O4
Chemical Name:
[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] (2S,3S)-2-[(4-chlorobenzoyl)amino]-3-methylpentanoate
Synonyms:
ZINC3365366;Z56954948;3-cyano-3-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-oxopropyl (2S,3S)-2-[(4-chlorophenyl)formamido]-3-methylpentanoate;956376-31-1

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[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] (2S,3S)-2-[(4-chlorobenzoyl)amino]-3-methylpentanoate Basic Attributes

Molecular Weight：

466.9 g/mol

Exact Mass：

466.1407829 g/mol

Characteristics

PSA：

128 Å²

Computed Properties

Molecular Weight:466.9
XLogP3:4.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:466.1407829
Monoisotopic Mass:466.1407829
Topological Polar Surface Area:128
Heavy Atom Count:33
Complexity:787
Defined Atom Stereocenter Count:2
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] (2S,3S)-2-[(4-chlorobenzoyl)amino]-3-methylpentanoate

Basic Attributes
Characteristics
Computed Properties
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