N-(4-chloro-2-fluorophenyl)-2-(4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-2-(4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
N-(4-chloro-2-fluorophenyl)-2-(4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | C201-0894 |
| Compound Name: | N-(4-chloro-2-fluorophenyl)-2-(4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide |
| Molecular Weight: | 387.82 |
| Molecular Formula: | C18 H11 Cl F N3 O2 S |
| Smiles: | C(C(Nc1ccc(cc1F)[Cl])=O)N1C=Nc2c3ccccc3sc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.7541 |
| logD: | 3.7477 |
| logSw: | -4.3118 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.285 |
| InChI Key: | FDDDKJTYOXLYNH-UHFFFAOYSA-N |