4-[3-(4-methoxybenzene-1-sulfonyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridin-7-yl]benzonitrile
Chemical Structure Depiction of
4-[3-(4-methoxybenzene-1-sulfonyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridin-7-yl]benzonitrile
4-[3-(4-methoxybenzene-1-sulfonyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridin-7-yl]benzonitrile
Compound characteristics
| Compound ID: | D563-0574 |
| Compound Name: | 4-[3-(4-methoxybenzene-1-sulfonyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridin-7-yl]benzonitrile |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C21 H16 N2 O4 S2 |
| Smiles: | COc1ccc(cc1)S(c1csc2C(CC(Nc12)=O)c1ccc(C#N)cc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8919 |
| logD: | 2.8918 |
| logSw: | -3.503 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.655 |
| InChI Key: | KFPZOACETXOFIG-KRWDZBQOSA-N |