5-benzyl-2-{[(2,4-dichlorophenyl)methyl]sulfanyl}-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
5-benzyl-2-{[(2,4-dichlorophenyl)methyl]sulfanyl}-6-methylpyrimidin-4(3H)-one
5-benzyl-2-{[(2,4-dichlorophenyl)methyl]sulfanyl}-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8018-0438 |
| Compound Name: | 5-benzyl-2-{[(2,4-dichlorophenyl)methyl]sulfanyl}-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 391.32 |
| Molecular Formula: | C19 H16 Cl2 N2 O S |
| Smiles: | CC1=C(Cc2ccccc2)C(NC(=N1)SCc1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1368 |
| logD: | 5.1002 |
| logSw: | -5.5757 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.881 |
| InChI Key: | FDHQSXVBWGOTGG-UHFFFAOYSA-N |