3-{1-[(2,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Chemical Structure Depiction of
3-{1-[(2,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
3-{1-[(2,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 2038-0085 |
| Compound Name: | 3-{1-[(2,4-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile |
| Molecular Weight: | 484.39 |
| Molecular Formula: | C27 H19 Cl2 N5 |
| Smiles: | Cc1ccc2c(c1)nc(/C(=C/c1cn(Cc3ccc(cc3[Cl])[Cl])nc1c1ccccc1)C#N)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 6.7217 |
| logD: | 6.7209 |
| logSw: | -6.4631 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.095 |
| InChI Key: | DLEWNEFXUQNUJL-UHFFFAOYSA-N |