1-{[2-(azepan-1-yl)ethyl]amino}-2-[(4-chlorophenyl)methyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
1-{[2-(azepan-1-yl)ethyl]amino}-2-[(4-chlorophenyl)methyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
1-{[2-(azepan-1-yl)ethyl]amino}-2-[(4-chlorophenyl)methyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | 4708-0174 |
| Compound Name: | 1-{[2-(azepan-1-yl)ethyl]amino}-2-[(4-chlorophenyl)methyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 472.03 |
| Molecular Formula: | C28 H30 Cl N5 |
| Smiles: | Cc1c(Cc2ccc(cc2)[Cl])c(NCCN2CCCCCC2)n2c3ccccc3nc2c1C#N |
| Stereo: | ACHIRAL |
| logP: | 6.8309 |
| logD: | 3.897 |
| logSw: | -6.6131 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.898 |
| InChI Key: | UDRJSGWLWUHWGX-UHFFFAOYSA-N |