Basic information
- Standard SMILES
O=C(NC(Cc1ccccc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)O)c1ccccc1- InChIKey
JFHFHARVQYOQAJ-UHFFFAOYSA-N- Molecular formula
- C25H24N2O5
- Average molar mass
- 432.5 g/mol
- Monoisotopic mass
- 432.16852187
Names & identifiers
- Preferred name
- 2-[(2-Benzamido-3-phenylpropanoyl)amino]-3-(4-hydroxyphenyl)propanoic acid
- IUPAC
- 2-[(2-benzamido-3-phenylpropanoyl)amino]-3-(4-hydroxyphenyl)propanoic acid
Names & synonyms
SCHEMBL11292707SCHEMBL11582248
Database identifiers
- PubChem CID
- 13293152
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 620
Related reactions
1 records
Compound notes
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