2-(1H-benzimidazol-2-yl)-3-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}prop-2-enenitrile
Compound characteristics
| Compound ID: | 8010-2265 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}prop-2-enenitrile |
| Molecular Weight: | 333.39 |
| Molecular Formula: | C20 H19 N3 O2 |
| Smiles: | CC(C)Oc1ccc(/C=C(C#N)/c2nc3ccccc3[nH]2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.968 |
| logD: | 3.9671 |
| logSw: | -4.2425 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.834 |
| InChI Key: | DQZIINNFQYBMTI-UHFFFAOYSA-N |