1-(3-methyl-4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazole
Chemical Structure Depiction of
1-(3-methyl-4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazole
1-(3-methyl-4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | 8004-9326 |
| Compound Name: | 1-(3-methyl-4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazole |
| Molecular Weight: | 194.15 |
| Molecular Formula: | C6 H6 N6 O2 |
| Smiles: | Cc1c(c([nH]n1)n1cncn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.0561 |
| logD: | 0.0548 |
| logSw: | -1.0148 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.118 |
| InChI Key: | VHRQXEWPDXNPIX-UHFFFAOYSA-N |