[1-(4-chloro-2-methoxyanilino)isoquinolin-4-yl][4-(4-fluorophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[1-(4-chloro-2-methoxyanilino)isoquinolin-4-yl][4-(4-fluorophenyl)piperazin-1-yl]methanone
[1-(4-chloro-2-methoxyanilino)isoquinolin-4-yl][4-(4-fluorophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | C066-2223 |
| Compound Name: | [1-(4-chloro-2-methoxyanilino)isoquinolin-4-yl][4-(4-fluorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 490.96 |
| Molecular Formula: | C27 H24 Cl F N4 O2 |
| Smiles: | COc1cc(ccc1Nc1c2ccccc2c(cn1)C(N1CCN(CC1)c1ccc(cc1)F)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.8297 |
| logD: | 5.4582 |
| logSw: | -5.997 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.498 |
| InChI Key: | HQFDQZNAOOLMFE-UHFFFAOYSA-N |