2-(1H-benzimidazol-2-yl)-3-[4-(difluoromethoxy)-3-methoxyphenyl]prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-[4-(difluoromethoxy)-3-methoxyphenyl]prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-[4-(difluoromethoxy)-3-methoxyphenyl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 8018-1646 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-[4-(difluoromethoxy)-3-methoxyphenyl]prop-2-enenitrile |
| Molecular Weight: | 341.32 |
| Molecular Formula: | C18 H13 F2 N3 O2 |
| Smiles: | COc1cc(/C=C(C#N)/c2nc3ccccc3[nH]2)ccc1OC(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.4416 |
| logD: | 3.4407 |
| logSw: | -3.7691 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.636 |
| InChI Key: | PJJXBNYLXDNWFI-UHFFFAOYSA-N |