3-[1-(4-chloro-2,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole
Chemical Structure Depiction of
3-[1-(4-chloro-2,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole
3-[1-(4-chloro-2,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole
Compound characteristics
Compound ID: | V005-9089 |
Compound Name: | 3-[1-(4-chloro-2,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole |
Molecular Weight: | 561.07 |
Molecular Formula: | C29 H28 Cl F3 N2 O2 S |
Smiles: | Cc1cc(c(C)cc1S(N1CCC(CC1)c1cn(Cc2ccc(cc2)C(F)(F)F)c2ccccc12)(=O)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 8.0493 |
logD: | 8.0493 |
logSw: | -6.68 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 33.41 |
InChI Key: | FRVWWHBDOVXTRF-UHFFFAOYSA-N |