3-(4-chlorobenzene-1-sulfonyl)-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-(4-chlorobenzene-1-sulfonyl)-7-{3-methoxy-2-[(prop-2-en-1-yl)oxy]phenyl}-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
3-(4-chlorobenzene-1-sulfonyl)-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: | D563-0248 |
| Compound Name: | 3-(4-chlorobenzene-1-sulfonyl)-7-{3-methoxy-2-[(prop-2-en-1-yl)oxy]phenyl}-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one |
| Molecular Weight: | 490 |
| Molecular Formula: | C23 H20 Cl N O5 S2 |
| Smiles: | COc1cccc(C2CC(Nc3c(csc23)S(c2ccc(cc2)[Cl])(=O)=O)=O)c1OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3791 |
| logD: | 4.379 |
| logSw: | -4.5427 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.276 |
| InChI Key: | XFUZVDLXFRZHBH-KRWDZBQOSA-N |