Basic information
- Standard SMILES
O=C(NC(Cc1cc2ccccc2[nH]c1=O)C(=O)O)c1ccc(Cl)cc1- InChIKey
PVUZAWYNDBSDTO-UHFFFAOYSA-N- Molecular formula
- C19H15ClN2O4
- Average molar mass
- 370.8 g/mol
- Monoisotopic mass
- 370.0720347
Names & identifiers
- Preferred name
- 2-(4-Chlorobenzoylamino)-3-(2-quinolon-3-yl)propionic acid
- IUPAC
- 2-[(4-chlorobenzoyl)amino]-3-(2-oxo-1H-quinolin-3-yl)propanoic acid
Names & synonyms
SCHEMBL9293454PVUZAWYNDBSDTO-UHFFFAOYSA-N2-(4-chlorobenzoylamino)-3-(2-quinolon-3-yl)propionic acid
Database identifiers
- PubChem CID
- 13342103
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 598
Related reactions
6 records
Compound notes
Loading…