2-(5-methyl-1H-benzimidazol-2-yl)-3-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}prop-2-enenitrile
Chemical Structure Depiction of
2-(5-methyl-1H-benzimidazol-2-yl)-3-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}prop-2-enenitrile
2-(5-methyl-1H-benzimidazol-2-yl)-3-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}prop-2-enenitrile
Compound characteristics
| Compound ID: | 2367-1196 |
| Compound Name: | 2-(5-methyl-1H-benzimidazol-2-yl)-3-{3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}prop-2-enenitrile |
| Molecular Weight: | 464.4 |
| Molecular Formula: | C24 H15 F3 N4 O3 |
| Smiles: | Cc1ccc2c(c1)nc(/C(=C/c1cccc(c1)Oc1ccc(cc1[N+]([O-])=O)C(F)(F)F)C#N)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 5.9005 |
| logD: | 5.9001 |
| logSw: | -5.7901 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.229 |
| InChI Key: | NDQGOGICSBXTBV-UHFFFAOYSA-N |