ethyl {4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}acetate
Chemical Structure Depiction of
ethyl {4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}acetate
ethyl {4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}acetate
Compound characteristics
| Compound ID: | 8006-2635 |
| Compound Name: | ethyl {4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}acetate |
| Molecular Weight: | 377.4 |
| Molecular Formula: | C21 H19 N3 O4 |
| Smiles: | CCOC(COc1ccc(/C=C(C#N)/c2nc3ccccc3[nH]2)cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0926 |
| logD: | 3.0918 |
| logSw: | -3.2477 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.689 |
| InChI Key: | UBXSLDUWDDHDDC-UHFFFAOYSA-N |