2-{[3-(2,5-dimethoxyphenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[3-(2,5-dimethoxyphenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
2-{[3-(2,5-dimethoxyphenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | C280-0458 |
| Compound Name: | 2-{[3-(2,5-dimethoxyphenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 473.54 |
| Molecular Formula: | C22 H20 F N3 O4 S2 |
| Smiles: | COc1ccc(c(c1)N1C(=NC2CCSC=2C1=O)SCC(Nc1ccc(cc1)F)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2602 |
| logD: | 3.2601 |
| logSw: | -3.6846 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.519 |
| InChI Key: | KUYHHTKIOLGQDI-UHFFFAOYSA-N |