4-[4-(2-fluorophenyl)piperazine-1-sulfonyl]-2-[2-oxo-2-(piperidin-1-yl)ethyl]isoquinolin-1(2H)-one
Chemical Structure Depiction of
4-[4-(2-fluorophenyl)piperazine-1-sulfonyl]-2-[2-oxo-2-(piperidin-1-yl)ethyl]isoquinolin-1(2H)-one
4-[4-(2-fluorophenyl)piperazine-1-sulfonyl]-2-[2-oxo-2-(piperidin-1-yl)ethyl]isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C265-0572 |
| Compound Name: | 4-[4-(2-fluorophenyl)piperazine-1-sulfonyl]-2-[2-oxo-2-(piperidin-1-yl)ethyl]isoquinolin-1(2H)-one |
| Molecular Weight: | 512.6 |
| Molecular Formula: | C26 H29 F N4 O4 S |
| Smiles: | C1CCN(CC1)C(CN1C=C(c2ccccc2C1=O)S(N1CCN(CC1)c1ccccc1F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3257 |
| logD: | 2.3257 |
| logSw: | -2.923 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.263 |
| InChI Key: | KSMLOIZNECCGKY-UHFFFAOYSA-N |