N-(3,4-dimethylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
N-(3,4-dimethylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | 1306-0029 |
| Compound Name: | N-(3,4-dimethylphenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 274.28 |
| Molecular Formula: | C13 H14 N4 O3 |
| Smiles: | Cc1ccc(cc1C)NC(c1c(cnn1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4456 |
| logD: | 2.4267 |
| logSw: | -2.7918 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.926 |
| InChI Key: | NHCHDVPEFSIFML-UHFFFAOYSA-N |