3-[(5-benzyl-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]-6-chloro-4-phenylquinolin-2(1H)-one
Chemical Structure Depiction of
3-[(5-benzyl-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]-6-chloro-4-phenylquinolin-2(1H)-one
3-[(5-benzyl-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]-6-chloro-4-phenylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | Y010-1598 |
| Compound Name: | 3-[(5-benzyl-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]-6-chloro-4-phenylquinolin-2(1H)-one |
| Molecular Weight: | 485.99 |
| Molecular Formula: | C27 H20 Cl N3 O2 S |
| Smiles: | Cc1c(Cc2ccccc2)c(nc(n1)SC1=C(c2ccccc2)c2cc(ccc2NC1=O)[Cl])O |
| Stereo: | ACHIRAL |
| logP: | 6.2577 |
| logD: | 6.2125 |
| logSw: | -5.7545 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.132 |
| InChI Key: | WOTDBNCMHNQEOI-UHFFFAOYSA-N |