Basic information
- CAS
18921-56-7- Standard SMILES
CCCC(NC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)O- InChIKey
GAXCZUJCTFFZLL-UHFFFAOYSA-N- Molecular formula
- C22H26N2O5
- Average molar mass
- 398.5 g/mol
- Monoisotopic mass
- 398.18417193
Names & identifiers
- Preferred name
- 2-[[3-Phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoic acid
- IUPAC
- 2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoic acid
Names & synonyms
18921-56-7NSC3340212-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoic acidDTXSID50318682NSC-334021DS-000156N-[(Benzyloxy)carbonyl]phenylalanylnorvalineL-norvaline,n-[n-[(phenylmethoxy)carbonyl]-l-phenylalanyl]-(9ci)
Database identifiers
- CAS
18921-56-7- PubChem CID
- 333353
- DTXSID
DTXSID50318682
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 527
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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