(R)-3-([1,1'-Biphenyl]-4-yl)-2-(((benzyloxy)carbonyl)amino)propanoic acid
Basic information
- CAS
176794-80-2- Standard SMILES
O=C(N[C@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O)OCc1ccccc1- InChIKey
ZZIBVIHXEMIHEQ-OAQYLSRUSA-N- Molecular formula
- C23H21NO4
- Average molar mass
- 375.4 g/mol
- Monoisotopic mass
- 375.14705815
Names & identifiers
- Preferred name
- (R)-3-([1,1'-Biphenyl]-4-yl)-2-(((benzyloxy)carbonyl)amino)propanoic acid
- IUPAC
- (2R)-2-(phenylmethoxycarbonylamino)-3-(4-phenylphenyl)propanoic acid
- English name
- Cbz-4-biphenyl-D-Ala
- Molecular formula
- C23H21NO4
- Molecular weight
- 375.42
Names & synonyms
176794-80-2CBZ-4-BIPHENYL-D-ALACbz-4-Biphenyl-D-alanineZ-D-Ala(4,4'-bipheyl)-OH(R)-3-([1,1'-Biphenyl]-4-yl)-2-(((benzyloxy)carbonyl)amino)propanoic acidMFCD02094552(2R)-2-(phenylmethoxycarbonylamino)-3-(4-phenylphenyl)propanoic acid[1,1'-Biphenyl]-4-propanoic acid, alpha-[[(phenylmethoxy)carbonyl]amino]-, (alphaR)-Z-P-PHENYL-D-PHENYLALANINESCHEMBL14509085DTXSID00426645AKOS015909215
Show more names
Z-D-BIP-OHZ-D-BPH-OHZ-D-BIP(4,4')-OHZ-P-PHENYL-D-PHE-OHZ-4-PHENYL-D-PHE-OHZ-D-PHE(4-PHENYL)-OHZ-D-4,4'-Biphenylalanine
BS-21818G84173F436537N-[(Benzyloxy)carbonyl]-4-phenyl-D-phenylalanine(2R)-2-(benzyloxycarbonylamino)-3-(4-phenylphenyl)propanoic acid(R)-3-([1,1'-Biphenyl]-4-yl)-2-(((benzyloxy)carbonyl)amino)propanoicacid
Database identifiers
- CAS
176794-80-2- PubChem CID
- 7010385
- DTXSID
DTXSID00426645
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 489
Physicochemical properties
- Boiling point
- 603 · 603.0±55.0 °C(Predicted)
- Density
- 1.23 · 1.230±0.06 g/cm3(Predicted)
- storage temp.
- Store at RT.
- pka
- 3.86 · 3.86±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…