3-[3-(4-fluorophenyl)-1-(4-methylbenzene-1-sulfonyl)-1H-pyrazol-4-yl]-2-(4-methylbenzene-1-sulfonyl)-1,2,3,5,6,10b-hexahydroimidazo[5,1-a]isoquinoline
Chemical Structure Depiction of
3-[3-(4-fluorophenyl)-1-(4-methylbenzene-1-sulfonyl)-1H-pyrazol-4-yl]-2-(4-methylbenzene-1-sulfonyl)-1,2,3,5,6,10b-hexahydroimidazo[5,1-a]isoquinoline
3-[3-(4-fluorophenyl)-1-(4-methylbenzene-1-sulfonyl)-1H-pyrazol-4-yl]-2-(4-methylbenzene-1-sulfonyl)-1,2,3,5,6,10b-hexahydroimidazo[5,1-a]isoquinoline
Compound characteristics
| Compound ID: | 8012-9277 |
| Compound Name: | 3-[3-(4-fluorophenyl)-1-(4-methylbenzene-1-sulfonyl)-1H-pyrazol-4-yl]-2-(4-methylbenzene-1-sulfonyl)-1,2,3,5,6,10b-hexahydroimidazo[5,1-a]isoquinoline |
| Molecular Weight: | 642.77 |
| Molecular Formula: | C34 H31 F N4 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(N1CC2c3ccccc3CCN2C1c1cn(nc1c1ccc(cc1)F)S(c1ccc(C)cc1)(=O)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.72 |
| logD: | 6.7199 |
| logSw: | -5.846 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 77.132 |
| InChI Key: | UZSKYILWQLPALK-UHFFFAOYSA-N |