2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(4-methylphenyl)ethan-1-one
Chemical Structure Depiction of
2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(4-methylphenyl)ethan-1-one
2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(4-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | Y020-1348 |
| Compound Name: | 2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(4-methylphenyl)ethan-1-one |
| Molecular Weight: | 416.95 |
| Molecular Formula: | C20 H17 Cl N2 O2 S2 |
| Smiles: | Cc1ccc(cc1)C(CSc1nc(CSc2ccc(cc2)[Cl])cc(n1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.397 |
| logD: | 5.0937 |
| logSw: | -5.6817 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.99 |
| InChI Key: | JXCNRVRGHYFZIU-UHFFFAOYSA-N |