3-[2-{[(4-fluorophenyl)methyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[(oxolan-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-[2-{[(4-fluorophenyl)methyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[(oxolan-2-yl)methyl]propanamide
3-[2-{[(4-fluorophenyl)methyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[(oxolan-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | C604-0249 |
| Compound Name: | 3-[2-{[(4-fluorophenyl)methyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[(oxolan-2-yl)methyl]propanamide |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C25 H24 F N3 O3 S2 |
| Smiles: | C1CC(CNC(CCN2C(=Nc3c4ccccc4sc3C2=O)SCc2ccc(cc2)F)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4895 |
| logD: | 3.4895 |
| logSw: | -3.7626 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.37 |
| InChI Key: | OFZPMAXLXNJORP-GOSISDBHSA-N |