1-methyl-4-nitro-N-(4-nitrophenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-4-nitro-N-(4-nitrophenyl)-1H-pyrazole-3-carboxamide
1-methyl-4-nitro-N-(4-nitrophenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y500-0249 |
| Compound Name: | 1-methyl-4-nitro-N-(4-nitrophenyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 291.22 |
| Molecular Formula: | C11 H9 N5 O5 |
| Smiles: | Cn1cc(c(C(Nc2ccc(cc2)[N+]([O-])=O)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.3023 |
| logD: | 0.4719 |
| logSw: | -2.326 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.147 |
| InChI Key: | QKNRBSGKIHXJRD-UHFFFAOYSA-N |