N-(3,5-dimethylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide
N-(3,5-dimethylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-6310 |
| Compound Name: | N-(3,5-dimethylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 290.28 |
| Molecular Formula: | C13 H14 N4 O4 |
| Smiles: | Cc1cc(C)cc(c1)NC(c1c(c(n[nH]1)OC)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8312 |
| logD: | 2.7358 |
| logSw: | -3.4072 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.942 |
| InChI Key: | BLVQCOLTMDYJNI-UHFFFAOYSA-N |