Basic information
- Standard SMILES
CCOC(=O)[C@H](C)C(Cc1ccc(-c2cccc(Cl)c2)cc1)NC(=O)OC(C)(C)C- InChIKey
XCMLEMSDZXCRPJ-UJONTBEJSA-N- Molecular formula
- C24H30ClNO4
- Average molar mass
- 431.9 g/mol
Names & identifiers
- Preferred name
- (R)-3-tert-butoxycarbonylamino-4-(3'-chloro-biphenyl-4-yl)-2-methyl-butyric acid ethyl ester
- IUPAC
- ethyl (2R)-4-[4-(3-chlorophenyl)phenyl]-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
Names & synonyms
SCHEMBL1912525XCMLEMSDZXCRPJ-UJONTBEJSA-N(R)-3-tert-butoxycarbonylamino-4-(3'-chloro-biphenyl-4-yl)-2-methyl-butyric acid ethyl ester
Database identifiers
- PubChem CID
- 67208757
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 554
Related reactions
6 records
Compound notes
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