N-(2-chloro-4-fluorophenyl)-1-(piperidin-1-yl)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-1-(piperidin-1-yl)isoquinoline-4-carboxamide
N-(2-chloro-4-fluorophenyl)-1-(piperidin-1-yl)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | G817-0534 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-1-(piperidin-1-yl)isoquinoline-4-carboxamide |
| Molecular Weight: | 383.85 |
| Molecular Formula: | C21 H19 Cl F N3 O |
| Smiles: | C1CCN(CC1)c1c2ccccc2c(cn1)C(Nc1ccc(cc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3603 |
| logD: | 5.351 |
| logSw: | -5.9374 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.883 |
| InChI Key: | CMYZJTQMMCFKFV-UHFFFAOYSA-N |