2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enenitrile
Compound characteristics
| Compound ID: | Y508-6943 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]prop-2-enenitrile |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C22 H23 N3 O2 |
| Smiles: | CC(C)CCOc1ccc(/C=C(C#N)/c2nc3ccccc3[nH]2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.016 |
| logD: | 5.0151 |
| logSw: | -4.5579 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.449 |
| InChI Key: | KQZUKDVBZWRUEW-UHFFFAOYSA-N |