2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}-N-(3-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}-N-(3-methoxyphenyl)acetamide
2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}-N-(3-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C688-1457 |
| Compound Name: | 2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl}-N-(3-methoxyphenyl)acetamide |
| Molecular Weight: | 489.52 |
| Molecular Formula: | C26 H20 F N3 O4 S |
| Smiles: | COc1cccc(c1)NC(CN1C(N(Cc2ccc(cc2)F)C(c2c1c1ccccc1s2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3002 |
| logD: | 5.3002 |
| logSw: | -5.5015 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.864 |
| InChI Key: | QOIOQJOVQSJUOI-UHFFFAOYSA-N |