4-[3-(benzenesulfonyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridin-7-yl]benzoic acid
Chemical Structure Depiction of
4-[3-(benzenesulfonyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridin-7-yl]benzoic acid
4-[3-(benzenesulfonyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridin-7-yl]benzoic acid
Compound characteristics
| Compound ID: | D563-0081 |
| Compound Name: | 4-[3-(benzenesulfonyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridin-7-yl]benzoic acid |
| Molecular Weight: | 413.47 |
| Molecular Formula: | C20 H15 N O5 S2 |
| Smiles: | C1C(c2ccc(cc2)C(O)=O)c2c(c(cs2)S(c2ccccc2)(=O)=O)NC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9183 |
| logD: | -0.0532 |
| logSw: | -3.4146 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.463 |
| InChI Key: | WRMWZIGEJAJRRV-HNNXBMFYSA-N |