4-(3-nitrophenyl)-1,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Chemical Structure Depiction of
4-(3-nitrophenyl)-1,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
4-(3-nitrophenyl)-1,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Compound characteristics
| Compound ID: | 7752-0114 |
| Compound Name: | 4-(3-nitrophenyl)-1,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine |
| Molecular Weight: | 308.3 |
| Molecular Formula: | C15 H12 N6 O2 |
| Smiles: | c1ccc2c(c1)nc1NC(N)=NC(c3cccc(c3)[N+]([O-])=O)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5898 |
| logD: | 2.2567 |
| logSw: | -3.0691 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.68 |
| InChI Key: | MKPGPLNWEGNLML-CYBMUJFWSA-N |