1-methyl-N-(2-methylphenyl)-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-N-(2-methylphenyl)-4-nitro-1H-pyrazole-3-carboxamide
1-methyl-N-(2-methylphenyl)-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | 1306-0269 |
| Compound Name: | 1-methyl-N-(2-methylphenyl)-4-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 260.25 |
| Molecular Formula: | C12 H12 N4 O3 |
| Smiles: | Cc1ccccc1NC(c1c(cn(C)n1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3697 |
| logD: | 1.3647 |
| logSw: | -2.0824 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.068 |
| InChI Key: | JEJKQYCUXWAJIO-UHFFFAOYSA-N |