5-benzyl-6-methyl-2-[(propan-2-yl)sulfanyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-benzyl-6-methyl-2-[(propan-2-yl)sulfanyl]pyrimidin-4(3H)-one
5-benzyl-6-methyl-2-[(propan-2-yl)sulfanyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4466-0294 |
| Compound Name: | 5-benzyl-6-methyl-2-[(propan-2-yl)sulfanyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 274.38 |
| Molecular Formula: | C15 H18 N2 O S |
| Smiles: | CC(C)SC1NC(C(Cc2ccccc2)=C(C)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.17 |
| logD: | 3.1368 |
| logSw: | -3.3333 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.153 |
| InChI Key: | RWAQBTVROFKCIX-UHFFFAOYSA-N |