N-butyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-butyl-4-nitro-1H-pyrazole-5-carboxamide
N-butyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | 8010-7777 |
| Compound Name: | N-butyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 212.2 |
| Molecular Formula: | C8 H12 N4 O3 |
| Smiles: | CCCCNC(c1c(cn[nH]1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0855 |
| logD: | 0.8818 |
| logSw: | -1.796 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.307 |
| InChI Key: | UTEGAXZLQOHKBI-UHFFFAOYSA-N |