N-benzyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-benzyl-4-nitro-1H-pyrazole-5-carboxamide
N-benzyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | 8011-6473 |
| Compound Name: | N-benzyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 246.22 |
| Molecular Formula: | C11 H10 N4 O3 |
| Smiles: | C(c1ccccc1)NC(c1c(cn[nH]1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.273 |
| logD: | 1.0279 |
| logSw: | -1.8012 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.194 |
| InChI Key: | XVBPNQIDODXICI-UHFFFAOYSA-N |