Basic information
- Standard SMILES
O=C(NCc1cn(-c2ccccc2)c2cc(Cl)ccc2c1=O)c1cccc(F)c1F- InChIKey
XMBDOUSYRDHMCC-UHFFFAOYSA-N- Molecular formula
- C23H15ClF2N2O2
- Average molar mass
- 424.8 g/mol
Names & identifiers
- Preferred name
- N-(7-Chloro-4-oxo-1-phenyl-1,4-dihydro-quinolin-3-ylmethyl)-2,3-difluoro-benzamide
- IUPAC
- N-[(7-chloro-4-oxo-1-phenylquinolin-3-yl)methyl]-2,3-difluorobenzamide
Names & synonyms
CHEMBL3679479SCHEMBL14575890XMBDOUSYRDHMCC-UHFFFAOYSA-NBDBM100499US8501732, I-59N-(7-Chloro-4-oxo-1-phenyl-1,4-dihydro-quinolin-3-ylmethyl)-2,3-difluoro-benzamide
Database identifiers
- PubChem CID
- 71208645
- ChEMBL
CHEMBL3679479
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 682
Related reactions
2 records
Compound notes
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