3-(4-methylbenzene-1-sulfonyl)-7-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
Chemical Structure Depiction of
3-(4-methylbenzene-1-sulfonyl)-7-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
3-(4-methylbenzene-1-sulfonyl)-7-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
Compound characteristics
| Compound ID: | D563-0185 |
| Compound Name: | 3-(4-methylbenzene-1-sulfonyl)-7-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C21 H16 F3 N O3 S2 |
| Smiles: | Cc1ccc(cc1)S(c1csc2C(CC(Nc12)=O)c1ccc(cc1)C(F)(F)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5512 |
| logD: | 4.5512 |
| logSw: | -4.3131 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.055 |
| InChI Key: | IYJHNVBLYLQNOV-INIZCTEOSA-N |