N-(4-ethoxyphenyl)-1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide
N-(4-ethoxyphenyl)-1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-7765 |
| Compound Name: | N-(4-ethoxyphenyl)-1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 304.3 |
| Molecular Formula: | C14 H16 N4 O4 |
| Smiles: | CCOc1ccc(cc1)NC(c1c(c(C)nn1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8596 |
| logD: | 1.8298 |
| logSw: | -2.4388 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.102 |
| InChI Key: | BROJYUUFSGQZOD-UHFFFAOYSA-N |