2-(1-methyl-1H-benzimidazol-2-yl)-3-{1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile
Chemical Structure Depiction of
2-(1-methyl-1H-benzimidazol-2-yl)-3-{1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile
2-(1-methyl-1H-benzimidazol-2-yl)-3-{1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile
Compound characteristics
| Compound ID: | Y070-1748 |
| Compound Name: | 2-(1-methyl-1H-benzimidazol-2-yl)-3-{1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile |
| Molecular Weight: | 475.62 |
| Molecular Formula: | C29 H25 N5 S |
| Smiles: | CCCSc1ccc(cc1)c1c(/C=C(/C#N)c2nc3ccccc3n2C)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.581 |
| logD: | 6.581 |
| logSw: | -5.9991 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.666 |
| InChI Key: | QEYIOEHUYODGMP-UHFFFAOYSA-N |