(2S)-2-[[(2S)-2-[(2-aminoacetyl)amino]-3-phenylpropanoyl]amino]-3-phenylpropanoic acid
Basic information
- CAS
13116-21-7- Standard SMILES
NCC(=O)NC(Cc1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)O- InChIKey
FEUPVVCGQLNXNP-UHFFFAOYSA-N- Molecular formula
- C20H23N3O4
- Average molar mass
- 369.4 g/mol
- Monoisotopic mass
- 369.16885622
Names & identifiers
- Preferred name
- (2S)-2-[[(2S)-2-[(2-aminoacetyl)amino]-3-phenylpropanoyl]amino]-3-phenylpropanoic acid
- IUPAC
- 2-[[2-[(2-aminoacetyl)amino]-3-phenylpropanoyl]amino]-3-phenylpropanoic acid
Names & synonyms
(2S)-2-[[(2S)-2-[(2-aminoacetyl)amino]-3-phenylpropanoyl]amino]-3-phenylpropanoic acidGly-Phe-Phe-OHNSC896452-[[2-[(2-aminoacetyl)amino]-3-phenylpropanoyl]amino]-3-phenylpropanoic acidNCIOpen2_009684SCHEMBL8068319NSC-896452-[[2-[(2-aminoacetyl)amino]-3-phenyl-propanoyl]amino]-3-phenyl-propanoic acid
Database identifiers
- CAS
13116-21-7- PubChem CID
- 259606
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 499
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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