5-(3-nitrophenyl)-3-[(1H-1,2,4-triazol-1-yl)methyl]-1H-1,2,4-triazole
Chemical Structure Depiction of
5-(3-nitrophenyl)-3-[(1H-1,2,4-triazol-1-yl)methyl]-1H-1,2,4-triazole
5-(3-nitrophenyl)-3-[(1H-1,2,4-triazol-1-yl)methyl]-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | 8020-3764 |
| Compound Name: | 5-(3-nitrophenyl)-3-[(1H-1,2,4-triazol-1-yl)methyl]-1H-1,2,4-triazole |
| Molecular Weight: | 271.24 |
| Molecular Formula: | C11 H9 N7 O2 |
| Smiles: | C(c1nc(c2cccc(c2)[N+]([O-])=O)[nH]n1)n1cncn1 |
| Stereo: | ACHIRAL |
| logP: | 0.8919 |
| logD: | 0.8064 |
| logSw: | -1.8337 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.372 |
| InChI Key: | SQGYRQRNTZPCFQ-UHFFFAOYSA-N |