1-hydroxy-3-methyl-2-({[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]imino}methyl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
1-hydroxy-3-methyl-2-({[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]imino}methyl)pyrido[1,2-a]benzimidazole-4-carbonitrile
1-hydroxy-3-methyl-2-({[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]imino}methyl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | 0960-0052 |
| Compound Name: | 1-hydroxy-3-methyl-2-({[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]imino}methyl)pyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 470.49 |
| Molecular Formula: | C29 H18 N4 O3 |
| Smiles: | Cc1c(/C=N/c2ccc(cc2)C2=Cc3ccccc3OC2=O)c(n2c3ccccc3nc2c1C#N)O |
| Stereo: | ACHIRAL |
| logP: | 4.8886 |
| logD: | 0.6141 |
| logSw: | -4.8235 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.317 |
| InChI Key: | VSWVNRIKHBUIGG-UHFFFAOYSA-N |