1-(benzenesulfonyl)-2-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-1H-benzimidazole
Chemical Structure Depiction of
1-(benzenesulfonyl)-2-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-1H-benzimidazole
1-(benzenesulfonyl)-2-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-1H-benzimidazole
Compound characteristics
Compound ID: | K653-0096 |
Compound Name: | 1-(benzenesulfonyl)-2-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-1H-benzimidazole |
Molecular Weight: | 448.48 |
Molecular Formula: | C21 H15 F3 N2 O2 S2 |
Smiles: | C(c1ccc(cc1)C(F)(F)F)Sc1nc2ccccc2n1S(c1ccccc1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.5959 |
logD: | 5.5959 |
logSw: | -6.0727 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 36.864 |
InChI Key: | XYTZNMWYOPEBHT-UHFFFAOYSA-N |