6-chloro-3-{[4-hydroxy-6-methyl-5-(prop-2-en-1-yl)pyrimidin-2-yl]sulfanyl}-4-phenylquinolin-2(1H)-one
Chemical Structure Depiction of
6-chloro-3-{[4-hydroxy-6-methyl-5-(prop-2-en-1-yl)pyrimidin-2-yl]sulfanyl}-4-phenylquinolin-2(1H)-one
6-chloro-3-{[4-hydroxy-6-methyl-5-(prop-2-en-1-yl)pyrimidin-2-yl]sulfanyl}-4-phenylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | Y010-0357 |
| Compound Name: | 6-chloro-3-{[4-hydroxy-6-methyl-5-(prop-2-en-1-yl)pyrimidin-2-yl]sulfanyl}-4-phenylquinolin-2(1H)-one |
| Molecular Weight: | 435.93 |
| Molecular Formula: | C23 H18 Cl N3 O2 S |
| Smiles: | Cc1c(CC=C)c(nc(n1)SC1=C(c2ccccc2)c2cc(ccc2NC1=O)[Cl])O |
| Stereo: | ACHIRAL |
| logP: | 5.3145 |
| logD: | 5.2255 |
| logSw: | -5.5951 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.403 |
| InChI Key: | HPTNAWQFGGONEB-UHFFFAOYSA-N |