N-(3,5-dimethoxyphenyl)-2-(9-fluoro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-2-(9-fluoro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
N-(3,5-dimethoxyphenyl)-2-(9-fluoro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | F464-0111 |
| Compound Name: | N-(3,5-dimethoxyphenyl)-2-(9-fluoro-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide |
| Molecular Weight: | 413.43 |
| Molecular Formula: | C20 H16 F N3 O4 S |
| Smiles: | COc1cc(cc(c1)OC)NC(CN1C=Nc2c3c(cccc3sc2C1=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4218 |
| logD: | 3.4217 |
| logSw: | -4.1519 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.071 |
| InChI Key: | IBPAASASJLBTED-UHFFFAOYSA-N |