N-(3-chloro-4-fluorophenyl)-2-(3,4-dimethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-(3,4-dimethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(3-chloro-4-fluorophenyl)-2-(3,4-dimethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | K937-0720 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-(3,4-dimethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 420.87 |
| Molecular Formula: | C24 H18 Cl F N2 O2 |
| Smiles: | Cc1ccc(cc1C)N1C=C(C(Nc2ccc(c(c2)[Cl])F)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 5.4201 |
| logD: | 4.9915 |
| logSw: | -5.8707 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.846 |
| InChI Key: | BIVRODGYPDXLBM-UHFFFAOYSA-N |