5-[2-(3,4-dimethylphenoxy)ethyl]-6-methyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
Chemical Structure Depiction of
5-[2-(3,4-dimethylphenoxy)ethyl]-6-methyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
5-[2-(3,4-dimethylphenoxy)ethyl]-6-methyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | 8018-0464 |
| Compound Name: | 5-[2-(3,4-dimethylphenoxy)ethyl]-6-methyl-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one |
| Molecular Weight: | 290.38 |
| Molecular Formula: | C15 H18 N2 O2 S |
| Smiles: | CC1=C(CCOc2ccc(C)c(C)c2)C(NC(N1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.702 |
| logD: | 3.5913 |
| logSw: | -3.9054 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.902 |
| InChI Key: | GXUVZQUOIWUJPW-UHFFFAOYSA-N |