4-(4-hydroxy-3-methoxyphenyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one
Chemical Structure Depiction of
4-(4-hydroxy-3-methoxyphenyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one
4-(4-hydroxy-3-methoxyphenyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one
Compound characteristics
| Compound ID: | 8019-6647 |
| Compound Name: | 4-(4-hydroxy-3-methoxyphenyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one |
| Molecular Weight: | 329.42 |
| Molecular Formula: | C18 H19 N O3 S |
| Smiles: | COc1cc(ccc1O)C1CC(Nc2c1c1CCCCc1s2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.215 |
| logD: | 3.2098 |
| logSw: | -3.2883 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.789 |
| InChI Key: | OTIIIECJIFUMFG-LBPRGKRZSA-N |