5-formyl-4-(4-methylpyridin-1-ium-1-yl)-1-phenyl-1H-imidazol-2-olate
Chemical Structure Depiction of
5-formyl-4-(4-methylpyridin-1-ium-1-yl)-1-phenyl-1H-imidazol-2-olate
5-formyl-4-(4-methylpyridin-1-ium-1-yl)-1-phenyl-1H-imidazol-2-olate
Compound characteristics
| Compound ID: | 1114-0172 |
| Compound Name: | 5-formyl-4-(4-methylpyridin-1-ium-1-yl)-1-phenyl-1H-imidazol-2-olate |
| Molecular Weight: | 279.3 |
| Molecular Formula: | C16 H13 N3 O2 |
| Smiles: | [H]C(c1c(nc(n1c1ccccc1)[O-])[n+]1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5693 |
| logD: | 2.5693 |
| logSw: | -2.286 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.104 |
| InChI Key: | BMWQJCRRKBWLIM-UHFFFAOYSA-N |