3-ethyl-7-(4-methylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-ethyl-7-(4-methylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
3-ethyl-7-(4-methylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F847-0335 |
| Compound Name: | 3-ethyl-7-(4-methylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 413.56 |
| Molecular Formula: | C21 H23 N3 O2 S2 |
| Smiles: | CCN1C(=Nc2c(csc2C1=O)c1ccc(C)cc1)SCC(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3228 |
| logD: | 4.3228 |
| logSw: | -4.2038 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.021 |
| InChI Key: | KSDVRDFQMHBUAI-UHFFFAOYSA-N |