3-{3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Chemical Structure Depiction of
3-{3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
3-{3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 2367-1088 |
| Compound Name: | 3-{3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile |
| Molecular Weight: | 494.43 |
| Molecular Formula: | C25 H17 F3 N4 O4 |
| Smiles: | Cc1ccc2c(c1)[nH]c(/C(=C/c1ccc(c(c1)OC)Oc1ccc(cc1C(F)(F)F)[N+]([O-])=O)C#N)n2 |
| Stereo: | ACHIRAL |
| logP: | 6.3089 |
| logD: | 6.3069 |
| logSw: | -5.7682 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.247 |
| InChI Key: | ADPLQZHFYWYHBE-UHFFFAOYSA-N |