Basic information
- CAS
4703-39-3- Standard SMILES
O=C(CNC(=O)c1ccccc1)NC(Cc1ccccc1)C(=O)O- InChIKey
CCLJGZGVIQBNDH-UHFFFAOYSA-N- Molecular formula
- C18H18N2O4
- Average molar mass
- 326.3 g/mol
- Monoisotopic mass
- 326.12665706
Overview
RN given for (L)-isomer
Names & identifiers
- Preferred name
- N-(hippuryl)phenylalanine
- IUPAC
- 2-[(2-benzamidoacetyl)amino]-3-phenylpropanoic acid
Names & synonyms
N-(Hippuryl)phenylalanineBzGly-PheRefChem:926953Hippuryl-L-((3)H)-phenylalanineEINECS 212-016-7Bz-Gly-Phe-OHNSC 83250N-(N-Benzoylglycyl)-3-phenyl-L-alanineNSC83250N-benzoylglycylphenylalanineSCHEMBL5679006NSC-83250
Show more names
AKOS003382448PD206468
Database identifiers
- CAS
4703-39-3、744-59-2- PubChem CID
- 98154
- EC Number
- 212-016-7
- Nikkaji
- J3.506.286F
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 440
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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