3-(4-cyano-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazol-2-yl)propanoic acid
Chemical Structure Depiction of
3-(4-cyano-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazol-2-yl)propanoic acid
3-(4-cyano-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazol-2-yl)propanoic acid
Compound characteristics
| Compound ID: | 8019-4706 |
| Compound Name: | 3-(4-cyano-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazol-2-yl)propanoic acid |
| Molecular Weight: | 295.3 |
| Molecular Formula: | C16 H13 N3 O3 |
| Smiles: | CC1=C(CCC(O)=O)C(N2C(=C1C#N)Nc1ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4016 |
| logD: | -1.0947 |
| logSw: | -1.9948 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.943 |
| InChI Key: | QRWDFJMBLRVKEP-UHFFFAOYSA-N |