2-{[(3-chloro-4-methylphenyl)imino]methyl}-1-hydroxy-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
2-{[(3-chloro-4-methylphenyl)imino]methyl}-1-hydroxy-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
2-{[(3-chloro-4-methylphenyl)imino]methyl}-1-hydroxy-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8008-8131 |
| Compound Name: | 2-{[(3-chloro-4-methylphenyl)imino]methyl}-1-hydroxy-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 374.83 |
| Molecular Formula: | C21 H15 Cl N4 O |
| Smiles: | Cc1ccc(cc1[Cl])/N=C/c1c(C)c(C#N)c2nc3ccccc3n2c1O |
| Stereo: | ACHIRAL |
| logP: | 5.0285 |
| logD: | 0.754 |
| logSw: | -4.8811 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.667 |
| InChI Key: | YIKQESSLCVQZGE-UHFFFAOYSA-N |