methyl 4-[(1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridin-2(1H)-yl)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[(1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridin-2(1H)-yl)methyl]benzoate
methyl 4-[(1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridin-2(1H)-yl)methyl]benzoate
Compound characteristics
| Compound ID: | G535-0067 |
| Compound Name: | methyl 4-[(1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridin-2(1H)-yl)methyl]benzoate |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C26 H27 N O2 S |
| Smiles: | COC(c1ccc(CN2CCc3c4CCCCc4sc3C2c2ccccc2)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5664 |
| logD: | 4.769 |
| logSw: | -5.754 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.224 |
| InChI Key: | FOBRYYDBSWRCTJ-XMMPIXPASA-N |