N-(4-bromo-2-fluorophenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
N-(4-bromo-2-fluorophenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | F464-0422 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide |
| Molecular Weight: | 446.3 |
| Molecular Formula: | C19 H13 Br F N3 O2 S |
| Smiles: | CC1=Nc2c3ccccc3sc2C(N1CC(Nc1ccc(cc1F)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2124 |
| logD: | 4.2028 |
| logSw: | -4.3314 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.332 |
| InChI Key: | KPZDXPVCMVMSMC-UHFFFAOYSA-N |