2-{[(2,3-dimethylphenyl)imino]methyl}-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
2-{[(2,3-dimethylphenyl)imino]methyl}-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
2-{[(2,3-dimethylphenyl)imino]methyl}-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | 6049-0948 |
| Compound Name: | 2-{[(2,3-dimethylphenyl)imino]methyl}-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 354.41 |
| Molecular Formula: | C22 H18 N4 O |
| Smiles: | CC1=C(/C=N/c2cccc(C)c2C)C(N2C(=C1C#N)Nc1ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6822 |
| logD: | 0.4077 |
| logSw: | -4.5542 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.969 |
| InChI Key: | ZRPNRMNNEFXMFK-UHFFFAOYSA-N |