3-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
3-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | K292-0205 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 348.44 |
| Molecular Formula: | C16 H16 N2 O3 S2 |
| Smiles: | COc1ccc(CCN2C(c3c(ccs3)NC2=S)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.7571 |
| logD: | 2.7552 |
| logSw: | -3.2962 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.576 |
| InChI Key: | XSJXPFAGFHEOMP-UHFFFAOYSA-N |