5-formyl-1-(4-methylphenyl)-4-(pyridin-1-ium-1-yl)-1H-imidazol-2-olate
Chemical Structure Depiction of
5-formyl-1-(4-methylphenyl)-4-(pyridin-1-ium-1-yl)-1H-imidazol-2-olate
5-formyl-1-(4-methylphenyl)-4-(pyridin-1-ium-1-yl)-1H-imidazol-2-olate
Compound characteristics
Compound ID: | 1420-0853 |
Compound Name: | 5-formyl-1-(4-methylphenyl)-4-(pyridin-1-ium-1-yl)-1H-imidazol-2-olate |
Molecular Weight: | 279.3 |
Molecular Formula: | C16 H13 N3 O2 |
Smiles: | Cc1ccc(cc1)n1c(C=O)c(nc1[O-])[n+]1ccccc1 |
Stereo: | ACHIRAL |
logP: | 2.7286 |
logD: | 2.7286 |
logSw: | -2.5724 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 45.104 |
InChI Key: | YJQTZMCQCQZVAR-UHFFFAOYSA-N |