5-[3-(3,5-dimethylanilino)-2-hydroxypropyl]-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
5-[3-(3,5-dimethylanilino)-2-hydroxypropyl]-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
5-[3-(3,5-dimethylanilino)-2-hydroxypropyl]-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | D724-0205 |
| Compound Name: | 5-[3-(3,5-dimethylanilino)-2-hydroxypropyl]-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 400.48 |
| Molecular Formula: | C24 H24 N4 O2 |
| Smiles: | CC1=CC(N2C(=C1C#N)N(CC(CNc1cc(C)cc(C)c1)O)c1ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.289 |
| logD: | 3.289 |
| logSw: | -3.4515 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.784 |
| InChI Key: | AGVRGEDLKAWVFU-IBGZPJMESA-N |