4-Chlorophenyl N-[(benzyloxy)carbonyl]phenylalaninate
Basic information
- CAS
3272-95-5- Standard SMILES
O=C(NC(Cc1ccccc1)C(=O)Oc1ccc(Cl)cc1)OCc1ccccc1- InChIKey
ZQVQATXYPIXCAU-UHFFFAOYSA-N- Molecular formula
- C23H20ClNO4
- Average molar mass
- 409.9 g/mol
- Monoisotopic mass
- 409.1080858
Names & identifiers
- Preferred name
- 4-Chlorophenyl N-[(benzyloxy)carbonyl]phenylalaninate
- IUPAC
- (4-chlorophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
Names & synonyms
NSC2971623272-95-5DTXSID70315759NSC297161NSC-297161NSC-2971624-Chlorophenyl N-[(benzyloxy)carbonyl]phenylalaninate
Database identifiers
- CAS
3272-95-5- PubChem CID
- 326249
- DTXSID
DTXSID70315759
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 509
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Compound notes
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