1-cyclopropyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-5-(trifluoromethyl)-1H-benzimidazole
Chemical Structure Depiction of
1-cyclopropyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-5-(trifluoromethyl)-1H-benzimidazole
1-cyclopropyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-5-(trifluoromethyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | 8017-3941 |
| Compound Name: | 1-cyclopropyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-5-(trifluoromethyl)-1H-benzimidazole |
| Molecular Weight: | 393.39 |
| Molecular Formula: | C18 H14 F3 N3 O2 S |
| Smiles: | C1CC1n1c2ccc(cc2nc1SCc1ccc(cc1)[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.186 |
| logD: | 5.186 |
| logSw: | -5.6377 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.766 |
| InChI Key: | JWTUWFSGQAFWRY-UHFFFAOYSA-N |