2-(2-cyanoethyl)-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
2-(2-cyanoethyl)-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
2-(2-cyanoethyl)-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8015-3841 |
| Compound Name: | 2-(2-cyanoethyl)-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 276.3 |
| Molecular Formula: | C16 H12 N4 O |
| Smiles: | CC1=C(CCC#N)C(N2C(=C1C#N)Nc1ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0854 |
| logD: | -0.2308 |
| logSw: | -1.5292 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.031 |
| InChI Key: | UYSMPUVLCHNWSC-UHFFFAOYSA-N |