6-chloro-4-phenyl-3-[(4-propoxypyrimidin-2-yl)sulfanyl]quinolin-2(1H)-one
Chemical Structure Depiction of
6-chloro-4-phenyl-3-[(4-propoxypyrimidin-2-yl)sulfanyl]quinolin-2(1H)-one
6-chloro-4-phenyl-3-[(4-propoxypyrimidin-2-yl)sulfanyl]quinolin-2(1H)-one
Compound characteristics
| Compound ID: | Y010-0431 |
| Compound Name: | 6-chloro-4-phenyl-3-[(4-propoxypyrimidin-2-yl)sulfanyl]quinolin-2(1H)-one |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C22 H18 Cl N3 O2 S |
| Smiles: | CCCOc1ccnc(n1)SC1=C(c2ccccc2)c2cc(ccc2NC1=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.8404 |
| logD: | 5.8398 |
| logSw: | -5.8627 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.616 |
| InChI Key: | YVQJLEITMJAAPG-UHFFFAOYSA-N |