3-{3-methoxy-4-[(4-methylphenyl)methoxy]phenyl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Chemical Structure Depiction of
3-{3-methoxy-4-[(4-methylphenyl)methoxy]phenyl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
3-{3-methoxy-4-[(4-methylphenyl)methoxy]phenyl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 2038-0146 |
| Compound Name: | 3-{3-methoxy-4-[(4-methylphenyl)methoxy]phenyl}-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile |
| Molecular Weight: | 409.49 |
| Molecular Formula: | C26 H23 N3 O2 |
| Smiles: | Cc1ccc(COc2ccc(/C=C(C#N)/c3nc4cc(C)ccc4[nH]3)cc2OC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6749 |
| logD: | 5.6745 |
| logSw: | -5.5862 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.259 |
| InChI Key: | AUEJAEBRBLEUBE-UHFFFAOYSA-N |