1-(1,2-dimethyl-1H-indol-3-yl)-2-(1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridin-2(1H)-yl)ethan-1-one
Chemical Structure Depiction of
1-(1,2-dimethyl-1H-indol-3-yl)-2-(1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridin-2(1H)-yl)ethan-1-one
1-(1,2-dimethyl-1H-indol-3-yl)-2-(1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridin-2(1H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | G535-0041 |
| Compound Name: | 1-(1,2-dimethyl-1H-indol-3-yl)-2-(1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridin-2(1H)-yl)ethan-1-one |
| Molecular Weight: | 454.63 |
| Molecular Formula: | C29 H30 N2 O S |
| Smiles: | Cc1c(C(CN2CCc3c4CCCCc4sc3C2c2ccccc2)=O)c2ccccc2n1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3234 |
| logD: | 3.9421 |
| logSw: | -5.702 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 19.5793 |
| InChI Key: | HFMHONRJQYQYBX-MUUNZHRXSA-N |