1-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)isoquinoline-4-carboxamide
Chemical Structure Depiction of
1-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)isoquinoline-4-carboxamide
1-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-1740 |
| Compound Name: | 1-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)isoquinoline-4-carboxamide |
| Molecular Weight: | 405.86 |
| Molecular Formula: | C23 H17 Cl F N3 O |
| Smiles: | Cc1ccc(cc1[Cl])Nc1c2ccccc2c(cn1)C(Nc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2149 |
| logD: | 6.2111 |
| logSw: | -6.1272 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.05 |
| InChI Key: | DXUVKXOYIXAEKS-UHFFFAOYSA-N |