4-(3-Chlorophenyl)-N-(2-fluorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
Basic information
- CAS
683785-11-7- Standard SMILES
CC1=C(C(=O)Nc2ccccc2F)C(c2cccc(Cl)c2)C2=C(CC(c3ccccc3)CC2=O)N1- InChIKey
CDDLSPCRYBWBGS-UHFFFAOYSA-N- Molecular formula
- C29H24ClFN2O2
- Average molar mass
- 487 g/mol
- Monoisotopic mass
- 486.1510339
Names & identifiers
- Preferred name
- 4-(3-Chlorophenyl)-N-(2-fluorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
- IUPAC
- 4-(3-chlorophenyl)-N-(2-fluorophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
Names & synonyms
Oprea1_713804AKOS001660116AKOS0219965604-(3-CHLOROPHENYL)-N-(2-FLUOROPHENYL)-2-METHYL-5-OXO-7-PHENYL-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBOXAMIDE4-(3-chlorophenyl)-N-(2-fluorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Database identifiers
- CAS
683785-11-7- PubChem CID
- 5221097
- EC Number
- 133-049-2
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 893
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