4-(4-nitro-1H-pyrazol-1-yl)-N-(4H-1,2,4-triazol-4-yl)butanamide
Chemical Structure Depiction of
4-(4-nitro-1H-pyrazol-1-yl)-N-(4H-1,2,4-triazol-4-yl)butanamide
4-(4-nitro-1H-pyrazol-1-yl)-N-(4H-1,2,4-triazol-4-yl)butanamide
Compound characteristics
| Compound ID: | 8016-1004 |
| Compound Name: | 4-(4-nitro-1H-pyrazol-1-yl)-N-(4H-1,2,4-triazol-4-yl)butanamide |
| Molecular Weight: | 265.23 |
| Molecular Formula: | C9 H11 N7 O3 |
| Smiles: | C(CC(Nn1cnnc1)=O)Cn1cc(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -1.7161 |
| logD: | -1.7161 |
| logSw: | -1.0147 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.116 |
| InChI Key: | JUUZGLGGMPYAEG-UHFFFAOYSA-N |