N-methyl-4-nitro-1-(propan-2-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-methyl-4-nitro-1-(propan-2-yl)-1H-pyrazole-3-carboxamide
N-methyl-4-nitro-1-(propan-2-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y507-5118 |
| Compound Name: | N-methyl-4-nitro-1-(propan-2-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 212.2 |
| Molecular Formula: | C8 H12 N4 O3 |
| Smiles: | CC(C)n1cc(c(C(NC)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.2849 |
| logD: | 0.2849 |
| logSw: | -1.3471 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.662 |
| InChI Key: | HHHFJXNTUGTMIM-UHFFFAOYSA-N |