5-[(2,5-dimethylphenyl)methyl]-2-(ethylsulfanyl)-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
5-[(2,5-dimethylphenyl)methyl]-2-(ethylsulfanyl)-6-methylpyrimidin-4(3H)-one
5-[(2,5-dimethylphenyl)methyl]-2-(ethylsulfanyl)-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8016-7588 |
| Compound Name: | 5-[(2,5-dimethylphenyl)methyl]-2-(ethylsulfanyl)-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 288.41 |
| Molecular Formula: | C16 H20 N2 O S |
| Smiles: | CCSC1NC(C(Cc2cc(C)ccc2C)=C(C)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0174 |
| logD: | 3.9303 |
| logSw: | -3.9127 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.153 |
| InChI Key: | JYIJLLDPDOVPDL-UHFFFAOYSA-N |