2-(butylsulfanyl)-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(butylsulfanyl)-6-methylpyrimidin-4(3H)-one
2-(butylsulfanyl)-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 1586-0046 |
| Compound Name: | 2-(butylsulfanyl)-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 198.28 |
| Molecular Formula: | C9 H14 N2 O S |
| Smiles: | CCCCSC1NC(C=C(C)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1615 |
| logD: | 1.427 |
| logSw: | -2.5576 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.571 |
| InChI Key: | IJMZSUIAWNDYKA-UHFFFAOYSA-N |