4-[2-cyano-2-(5-methyl-1H-benzimidazol-2-yl)ethenyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate
Chemical Structure Depiction of
4-[2-cyano-2-(5-methyl-1H-benzimidazol-2-yl)ethenyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate
4-[2-cyano-2-(5-methyl-1H-benzimidazol-2-yl)ethenyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate
Compound characteristics
| Compound ID: | 1809-0081 |
| Compound Name: | 4-[2-cyano-2-(5-methyl-1H-benzimidazol-2-yl)ethenyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate |
| Molecular Weight: | 479.87 |
| Molecular Formula: | C25 H16 Cl F2 N3 O3 |
| Smiles: | Cc1ccc2c(c1)nc(/C(=C/c1ccc(c(c1)OC)OC(c1cc(c(cc1[Cl])F)F)=O)C#N)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 6.2707 |
| logD: | 6.2702 |
| logSw: | -6.2691 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.409 |
| InChI Key: | KQTAVPOXBGRIOJ-UHFFFAOYSA-N |