2-{[(3-methylphenyl)methyl]sulfanyl}-6-propylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-methylphenyl)methyl]sulfanyl}-6-propylpyrimidin-4(3H)-one
2-{[(3-methylphenyl)methyl]sulfanyl}-6-propylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 3931-0399 |
| Compound Name: | 2-{[(3-methylphenyl)methyl]sulfanyl}-6-propylpyrimidin-4(3H)-one |
| Molecular Weight: | 274.38 |
| Molecular Formula: | C15 H18 N2 O S |
| Smiles: | CCCC1=CC(NC(=N1)SCc1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7139 |
| logD: | 3.178 |
| logSw: | -3.7722 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.907 |
| InChI Key: | QOZQWKQXLVHPLJ-UHFFFAOYSA-N |