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[2-(5-chloro-2-cyanoanilino)-2-oxoethyl] (2S)-2-[(4-methoxybenzoyl)amino]-3-methylbutanoate

[2-(5-chloro-2-cyanoanilino)-2-oxoethyl] (2S)-2-[(4-methoxybenzoyl)amino]-3-methylbutanoate structure

CAS No:
956453-03-5
Formula:
C22H22ClN3O5
Chemical Name:
[2-(5-chloro-2-cyanoanilino)-2-oxoethyl] (2S)-2-[(4-methoxybenzoyl)amino]-3-methylbutanoate
Synonyms:
ZINC3283884;AKOS001043896;MCULE-1389514671;AB00721636-01;Z56946298;[(5-chloro-2-cyanophenyl)carbamoyl]methyl (2S)-2-[(4-methoxyphenyl)formamido]-3-methylbutanoate;956453-03-5

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[2-(5-chloro-2-cyanoanilino)-2-oxoethyl] (2S)-2-[(4-methoxybenzoyl)amino]-3-methylbutanoate Basic Attributes

Molecular Weight：

443.9 g/mol

Exact Mass：

443.1247985 g/mol

Characteristics

PSA：

118 Å²

Computed Properties

Molecular Weight:443.9
XLogP3:4.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:443.1247985
Monoisotopic Mass:443.1247985
Topological Polar Surface Area:118
Heavy Atom Count:31
Complexity:684
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] (2S)-2-[(4-methoxybenzoyl)amino]-3-methylbutanoate

Basic Attributes
Characteristics
Computed Properties
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