2-butyl-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
2-butyl-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
2-butyl-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | 5228-5371 |
| Compound Name: | 2-butyl-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 279.34 |
| Molecular Formula: | C17 H17 N3 O |
| Smiles: | CCCCC1=C(C)C(C#N)=C2Nc3ccccc3N2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.589 |
| logD: | 3.5886 |
| logSw: | -3.6046 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.559 |
| InChI Key: | QKRFNJZLDFJRQC-UHFFFAOYSA-N |