2-(1H-benzimidazol-2-yl)-3-(4-hydroxy-3-nitrophenyl)prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-(4-hydroxy-3-nitrophenyl)prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-(4-hydroxy-3-nitrophenyl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 3448-3390 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-(4-hydroxy-3-nitrophenyl)prop-2-enenitrile |
| Molecular Weight: | 306.28 |
| Molecular Formula: | C16 H10 N4 O3 |
| Smiles: | C(=C(C#N)/c1nc2ccccc2[nH]1)\c1ccc(c(c1)[N+]([O-])=O)O |
| Stereo: | ACHIRAL |
| logP: | 3.4538 |
| logD: | 2.6605 |
| logSw: | -3.6763 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.943 |
| InChI Key: | AUXSCZVVBXKHSB-UHFFFAOYSA-N |