2-({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
2-({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | K292-0288 |
| Compound Name: | 2-({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 489.54 |
| Molecular Formula: | C23 H18 F3 N3 O2 S2 |
| Smiles: | Cc1ccc(CN2C(=Nc3ccsc3C2=O)SCC(Nc2ccccc2C(F)(F)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3257 |
| logD: | 5.3257 |
| logSw: | -5.2278 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.241 |
| InChI Key: | HGPWFWQFRNSMCL-UHFFFAOYSA-N |