1-hydroxy-3-methyl-2-({[4-(4-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
1-hydroxy-3-methyl-2-({[4-(4-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)pyrido[1,2-a]benzimidazole-4-carbonitrile
1-hydroxy-3-methyl-2-({[4-(4-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
| Compound ID: | 0960-0097 |
| Compound Name: | 1-hydroxy-3-methyl-2-({[4-(4-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)pyrido[1,2-a]benzimidazole-4-carbonitrile |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C28 H19 N5 O2 |
| Smiles: | Cc1cccc2c1nc(c1ccc(cc1)/N=C/c1c(C)c(C#N)c3nc4ccccc4n3c1O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.7079 |
| logD: | 1.4335 |
| logSw: | -5.7535 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.248 |
| InChI Key: | HAQHLTOZQZCRFL-UHFFFAOYSA-N |