4-(4-hydroxy-3-methoxyphenyl)-7-methyl-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)-7-methyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one
4-(4-hydroxy-3-methoxyphenyl)-7-methyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one
Compound characteristics
| Compound ID: | 8019-6785 |
| Compound Name: | 4-(4-hydroxy-3-methoxyphenyl)-7-methyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one |
| Molecular Weight: | 343.44 |
| Molecular Formula: | C19 H21 N O3 S |
| Smiles: | CC1CCc2c3C(CC(Nc3sc2C1)=O)c1ccc(c(c1)OC)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.649 |
| logD: | 3.6437 |
| logSw: | -3.7366 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.789 |
| InChI Key: | AAUDZRQKQXRTFP-UHFFFAOYSA-N |