N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-nitrobenzamide
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | 3693-0041 |
| Compound Name: | N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-nitrobenzamide |
| Molecular Weight: | 260.25 |
| Molecular Formula: | C12 H12 N4 O3 |
| Smiles: | Cc1c(c(C)[nH]n1)NC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.297 |
| logD: | 1.285 |
| logSw: | -2.3054 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.231 |
| InChI Key: | AXAGAJMFFWLJIW-UHFFFAOYSA-N |