2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | K292-0355 |
| Compound Name: | 2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 540.38 |
| Molecular Formula: | C21 H13 Br F3 N3 O2 S2 |
| Smiles: | C(C(Nc1cccc(c1)C(F)(F)F)=O)SC1=Nc2ccsc2C(N1c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7882 |
| logD: | 5.788 |
| logSw: | -6.061 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.327 |
| InChI Key: | ZYBNQRPDOZRWGS-UHFFFAOYSA-N |