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Phenyl L-Z-Isoleucinamide

HCID 7610239
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Basic information

CAS
134015-93-3
Standard SMILES
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1
InChIKey
OYDMDVAWACLEQO-YJBOKZPZSA-N
Molecular formula
C20H24N2O3
Average molar mass
340.4 g/mol
Monoisotopic mass
340.17869263

Names & identifiers

Preferred name
Phenyl L-Z-Isoleucinamide
IUPAC
benzyl N-[(2S,3S)-1-anilino-3-methyl-1-oxopentan-2-yl]carbamate

Names & synonyms

Phenyl L-Z-Isoleucinamide134015-93-3benzyl N-[(2S,3S)-1-anilino-3-methyl-1-oxopentan-2-yl]carbamateMFCD22689106PhenylL-Z-IsoleucinamideDTXSID801121124BENZYL N-[(1S,2S)-2-METHYL-1-(PHENYLCARBAMOYL)BUTYL]CARBAMATEBS-26737N~2~-[(Benzyloxy)carbonyl]-N-phenyl-L-isoleucinamideCarbamic acid, [2-methyl-1-[(phenylamino)carbonyl]butyl]-, phenylmethyl ester, [S-(R*,R*)]-

Database identifiers

CAS
134015-93-3
PubChem CID
7610239
DTXSID
DTXSID801121124

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
67.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
25
Formal charge
0
Complexity
415

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