3-(4-methylbenzene-1-sulfonyl)-7-{4-[(prop-2-en-1-yl)oxy]phenyl}-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
Chemical Structure Depiction of
3-(4-methylbenzene-1-sulfonyl)-7-{4-[(prop-2-en-1-yl)oxy]phenyl}-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
3-(4-methylbenzene-1-sulfonyl)-7-{4-[(prop-2-en-1-yl)oxy]phenyl}-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
Compound characteristics
| Compound ID: | D563-0139 |
| Compound Name: | 3-(4-methylbenzene-1-sulfonyl)-7-{4-[(prop-2-en-1-yl)oxy]phenyl}-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one |
| Molecular Weight: | 439.55 |
| Molecular Formula: | C23 H21 N O4 S2 |
| Smiles: | Cc1ccc(cc1)S(c1csc2C(CC(Nc12)=O)c1ccc(cc1)OCC=C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2116 |
| logD: | 4.2115 |
| logSw: | -4.1816 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.472 |
| InChI Key: | QJIXBPZKALDSNO-IBGZPJMESA-N |