6-chloro-3-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-4-phenylquinolin-2(1H)-one
Chemical Structure Depiction of
6-chloro-3-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-4-phenylquinolin-2(1H)-one
6-chloro-3-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-4-phenylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | 5742-0791 |
| Compound Name: | 6-chloro-3-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-4-phenylquinolin-2(1H)-one |
| Molecular Weight: | 412.94 |
| Molecular Formula: | C22 H21 Cl N2 O2 S |
| Smiles: | C1CCN(CC1)C(CSC1=C(c2ccccc2)c2cc(ccc2NC1=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4683 |
| logD: | 4.4679 |
| logSw: | -4.6132 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.965 |
| InChI Key: | PKVPUPIBFOPBQS-UHFFFAOYSA-N |