Basic information
- Standard SMILES
O=C(NCc1c(-c2ncco2)n(-c2ccccc2)c2cc(Cl)ccc2c1=O)c1ccn(Cc2ccccc2)c(=O)c1- InChIKey
CDEQUNLOBIAUNN-UHFFFAOYSA-N- Molecular formula
- C32H23ClN4O4
- Average molar mass
- 563 g/mol
Names & identifiers
- Preferred name
- 1-Benzyl-2-oxo-1,2-dihydro-pyridine-4-carboxylic acid (7-chloro-2-oxazol-2-yl-4-oxo-1-phenyl-1,4-dihydro-quinolin-3-ylmethyl)-amide
- IUPAC
- 1-benzyl-N-[[7-chloro-2-(1,3-oxazol-2-yl)-4-oxo-1-phenylquinolin-3-yl]methyl]-2-oxopyridine-4-carboxamide
Names & synonyms
CHEMBL3679421SCHEMBL14617088CDEQUNLOBIAUNN-UHFFFAOYSA-NBDBM100437PMID25991433-Compound-E3US8501732, I-11-Benzyl-2-oxo-1,2-dihydro-pyridine-4-carboxylic acid (7-chloro-2-oxazol-2-yl-4-oxo-1-phenyl-1,4-dihydro-quinolin-3-ylmethyl)-amide
Database identifiers
- PubChem CID
- 71217329
- ChEMBL
CHEMBL3679421
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 95.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 1,110
Related reactions
2 records
Compound notes
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