methyl 4-cyano-3-hydroxypyrido[1,2-a]benzimidazole-2-carboxylate
Chemical Structure Depiction of
methyl 4-cyano-3-hydroxypyrido[1,2-a]benzimidazole-2-carboxylate
methyl 4-cyano-3-hydroxypyrido[1,2-a]benzimidazole-2-carboxylate
Compound characteristics
| Compound ID: | 8016-0461 |
| Compound Name: | methyl 4-cyano-3-hydroxypyrido[1,2-a]benzimidazole-2-carboxylate |
| Molecular Weight: | 267.24 |
| Molecular Formula: | C14 H9 N3 O3 |
| Smiles: | COC(c1cn2c3ccccc3nc2c(C#N)c1O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4395 |
| logD: | 0.2643 |
| logSw: | -2.4985 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.234 |
| InChI Key: | ZJVIDPGXXUTNLL-UHFFFAOYSA-N |