3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Chemical Structure Depiction of
3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Compound characteristics
| Compound ID: | Y070-1336 |
| Compound Name: | 3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C29 H25 N5 O |
| Smiles: | CCOc1ccc(cc1C)c1c(/C=C(/C#N)c2nc3ccccc3n2C)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.2015 |
| logD: | 6.2015 |
| logSw: | -5.6707 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 49.876 |
| InChI Key: | WHXVCDKITZCTHT-UHFFFAOYSA-N |