Basic information
- Standard SMILES
CC(C)(C)OC(=O)N[C@@H](Cc1cccc(C(=O)c2ccccc2)c1)C(=O)O- InChIKey
PWQUPJGIGRVPBW-KRWDZBQOSA-N- Molecular formula
- C21H23NO5
- Average molar mass
- 369.4 g/mol
- Monoisotopic mass
- 369.15762283
Names & identifiers
- Preferred name
- N-BOC-m-Benzoyl-L-Phenylalanine
- IUPAC
- (2S)-3-(3-benzoylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Names & synonyms
Boc-L-Phe(3-Bp)-OHSCHEMBL7444137N-BOC-m-Benzoyl-L-PhenylalaninePWQUPJGIGRVPBW-KRWDZBQOSA-NEX-A16836D117667-00-2
Database identifiers
- PubChem CID
- 14233370
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 92.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 533
Related reactions
1 records
Compound notes
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