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ethyl (2R,3S)-2-[[4-(4-bromoanilino)-4-oxobutanoyl]amino]-3-hydroxy-3-phenylpropanoate

ethyl (2R,3S)-2-[[4-(4-bromoanilino)-4-oxobutanoyl]amino]-3-hydroxy-3-phenylpropanoate structure

CAS No:
481701-97-7
Formula:
C21H23BrN2O5
Chemical Name:
ethyl (2R,3S)-2-[[4-(4-bromoanilino)-4-oxobutanoyl]amino]-3-hydroxy-3-phenylpropanoate
Synonyms:
C21H23BrN2O5;ZINC2105388;STL566364;AKOS030499774;MCULE-6434891127;ethyl (betaS)-N-{4-[(4-bromophenyl)amino]-4-oxobutanoyl}-beta-hydroxy-D-phenylalaninate;481701-97-7

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ethyl (2R,3S)-2-[[4-(4-bromoanilino)-4-oxobutanoyl]amino]-3-hydroxy-3-phenylpropanoate Basic Attributes

Molecular Weight：

463.3 g/mol

Exact Mass：

462.07903 g/mol

Characteristics

PSA：

105 Å²

Computed Properties

Molecular Weight:463.3
XLogP3:2.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:462.07903
Monoisotopic Mass:462.07903
Topological Polar Surface Area:105
Heavy Atom Count:29
Complexity:545
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl (2R,3S)-2-[[4-(4-bromoanilino)-4-oxobutanoyl]amino]-3-hydroxy-3-phenylpropanoate

Basic Attributes
Characteristics
Computed Properties
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