2-butyl-1-{4-[2-(2,5-dimethyl-1H-pyrrol-1-yl)ethyl]piperazin-1-yl}-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
2-butyl-1-{4-[2-(2,5-dimethyl-1H-pyrrol-1-yl)ethyl]piperazin-1-yl}-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
2-butyl-1-{4-[2-(2,5-dimethyl-1H-pyrrol-1-yl)ethyl]piperazin-1-yl}-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | 4852-0843 |
| Compound Name: | 2-butyl-1-{4-[2-(2,5-dimethyl-1H-pyrrol-1-yl)ethyl]piperazin-1-yl}-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 468.65 |
| Molecular Formula: | C29 H36 N6 |
| Smiles: | CCCCc1c(C)c(C#N)c2nc3ccccc3n2c1N1CCN(CC1)CCn1c(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 6.3203 |
| logD: | 6.2682 |
| logSw: | -5.659 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 33.28 |
| InChI Key: | PQDRCVJEJHBKEL-UHFFFAOYSA-N |