N-benzyl-3-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-benzyl-3-nitro-1H-pyrazole-5-carboxamide
N-benzyl-3-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-7601 |
| Compound Name: | N-benzyl-3-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 246.22 |
| Molecular Formula: | C11 H10 N4 O3 |
| Smiles: | C(c1ccccc1)NC(c1cc(n[nH]1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2865 |
| logD: | 1.0415 |
| logSw: | -2.0813 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.258 |
| InChI Key: | ZHMQTMYBLOOCFG-UHFFFAOYSA-N |