3-[3-(3-chloro-4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Chemical Structure Depiction of
3-[3-(3-chloro-4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
3-[3-(3-chloro-4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Compound characteristics
| Compound ID: | Y070-1753 |
| Compound Name: | 3-[3-(3-chloro-4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile |
| Molecular Weight: | 479.97 |
| Molecular Formula: | C28 H22 Cl N5 O |
| Smiles: | CCOc1ccc(cc1[Cl])c1c(/C=C(/C#N)c2nc3ccccc3n2C)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.9833 |
| logD: | 5.9833 |
| logSw: | -6.2325 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 49.876 |
| InChI Key: | LIHUGAGRSLFNTP-UHFFFAOYSA-N |