2-[2,4-dioxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[2,4-dioxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-fluorophenyl)acetamide
2-[2,4-dioxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | C258-0608 |
| Compound Name: | 2-[2,4-dioxo-3-(2-phenylethyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-(3-fluorophenyl)acetamide |
| Molecular Weight: | 477.56 |
| Molecular Formula: | C26 H24 F N3 O3 S |
| Smiles: | C1CCc2c(C1)c1C(N(CCc3ccccc3)C(N(CC(Nc3cccc(c3)F)=O)c1s2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4702 |
| logD: | 5.4701 |
| logSw: | -5.7435 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.767 |
| InChI Key: | XGOKDSFDLPIZOB-UHFFFAOYSA-N |