N-(2,4-dimethylphenyl)-2-methyl-4-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-2-methyl-4-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide
N-(2,4-dimethylphenyl)-2-methyl-4-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide
Compound characteristics
| Compound ID: | 8016-5880 |
| Compound Name: | N-(2,4-dimethylphenyl)-2-methyl-4-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide |
| Molecular Weight: | 497.51 |
| Molecular Formula: | C27 H23 N5 O5 |
| Smiles: | CC1=C(C(c2cc3c(cc2[N+]([O-])=O)OCO3)n2c3ccccc3nc2N1)C(Nc1ccc(C)cc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3046 |
| logD: | 5.3045 |
| logSw: | -5.2632 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.623 |
| InChI Key: | YXYNARUNKLHSLS-VWLOTQADSA-N |