N-[(2-chlorophenyl)methyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carboxamide
N-[(2-chlorophenyl)methyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0255 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carboxamide |
| Molecular Weight: | 474.96 |
| Molecular Formula: | C27 H24 Cl F N4 O |
| Smiles: | C(c1ccccc1[Cl])NC(c1ccc2ccnc(c2c1)N1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8625 |
| logD: | 5.8489 |
| logSw: | -6.1743 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.074 |
| InChI Key: | WTFBKOYYRYYYQB-UHFFFAOYSA-N |