7-(3-ethoxy-4-hydroxyphenyl)-3-(4-methylbenzene-1-sulfonyl)-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
Chemical Structure Depiction of
7-(3-ethoxy-4-hydroxyphenyl)-3-(4-methylbenzene-1-sulfonyl)-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
7-(3-ethoxy-4-hydroxyphenyl)-3-(4-methylbenzene-1-sulfonyl)-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one
Compound characteristics
| Compound ID: | D563-0145 |
| Compound Name: | 7-(3-ethoxy-4-hydroxyphenyl)-3-(4-methylbenzene-1-sulfonyl)-6,7-dihydrothieno[3,2-b]pyridin-5(4H)-one |
| Molecular Weight: | 443.54 |
| Molecular Formula: | C22 H21 N O5 S2 |
| Smiles: | CCOc1cc(ccc1O)C1CC(Nc2c(csc12)S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4797 |
| logD: | 3.4778 |
| logSw: | -3.445 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.813 |
| InChI Key: | MJAJWJPEOAIPIS-INIZCTEOSA-N |