6-[4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)thieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)hexanamide
Chemical Structure Depiction of
6-[4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)thieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)hexanamide
6-[4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)thieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)hexanamide
Compound characteristics
| Compound ID: | K292-1188 |
| Compound Name: | 6-[4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)thieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)hexanamide |
| Molecular Weight: | 602.7 |
| Molecular Formula: | C29 H29 F3 N4 O3 S2 |
| Smiles: | C(CCC(NCCc1ccccc1)=O)CCN1C(=Nc2ccsc2C1=O)SCC(Nc1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5766 |
| logD: | 4.5766 |
| logSw: | -4.3848 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.532 |
| InChI Key: | ZMDQAKURUKLICY-UHFFFAOYSA-N |