3-(benzenesulfonyl)-7-{3-methoxy-2-[(prop-2-en-1-yl)oxy]phenyl}-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-7-{3-methoxy-2-[(prop-2-en-1-yl)oxy]phenyl}-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
3-(benzenesulfonyl)-7-{3-methoxy-2-[(prop-2-en-1-yl)oxy]phenyl}-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
Compound characteristics
| Compound ID: | D563-0016 |
| Compound Name: | 3-(benzenesulfonyl)-7-{3-methoxy-2-[(prop-2-en-1-yl)oxy]phenyl}-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one |
| Molecular Weight: | 455.55 |
| Molecular Formula: | C23 H21 N O5 S2 |
| Smiles: | COc1cccc(C2CC(Nc3c(csc23)S(c2ccccc2)(=O)=O)=O)c1OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5993 |
| logD: | 3.5993 |
| logSw: | -3.8292 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.276 |
| InChI Key: | ZGZCNISGRIQKAD-KRWDZBQOSA-N |