2-(1H-benzimidazol-2-yl)-3-{3-methoxy-4-[(4-methylphenyl)methoxy]phenyl}prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-{3-methoxy-4-[(4-methylphenyl)methoxy]phenyl}prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-{3-methoxy-4-[(4-methylphenyl)methoxy]phenyl}prop-2-enenitrile
Compound characteristics
| Compound ID: | 2038-0093 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-{3-methoxy-4-[(4-methylphenyl)methoxy]phenyl}prop-2-enenitrile |
| Molecular Weight: | 395.46 |
| Molecular Formula: | C25 H21 N3 O2 |
| Smiles: | Cc1ccc(COc2ccc(/C=C(C#N)/c3nc4ccccc4[nH]3)cc2OC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2152 |
| logD: | 5.2143 |
| logSw: | -5.2664 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.259 |
| InChI Key: | RAFNLOOXFJXHOA-UHFFFAOYSA-N |