N-(3-chloro-4-fluorophenyl)-1-(piperidin-1-yl)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-1-(piperidin-1-yl)isoquinoline-4-carboxamide
N-(3-chloro-4-fluorophenyl)-1-(piperidin-1-yl)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | G817-0526 |
| Compound Name: | N-(3-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(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4591 |
| logD: | 5.4498 |
| logSw: | -6.023 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.581 |
| InChI Key: | YBOUISHBPZFSJZ-UHFFFAOYSA-N |