1-{[3-(1H-imidazol-1-yl)propyl]amino}-3-methyl-2-[(4-methylphenyl)methyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
1-{[3-(1H-imidazol-1-yl)propyl]amino}-3-methyl-2-[(4-methylphenyl)methyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
1-{[3-(1H-imidazol-1-yl)propyl]amino}-3-methyl-2-[(4-methylphenyl)methyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | D724-0188 |
| Compound Name: | 1-{[3-(1H-imidazol-1-yl)propyl]amino}-3-methyl-2-[(4-methylphenyl)methyl]pyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 434.54 |
| Molecular Formula: | C27 H26 N6 |
| Smiles: | Cc1ccc(Cc2c(C)c(C#N)c3nc4ccccc4n3c2NCCCn2ccnc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2319 |
| logD: | 4.9901 |
| logSw: | -5.1035 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.385 |
| InChI Key: | GNCZBMIBVFONFQ-UHFFFAOYSA-N |