N-(3-methoxy-5-nitrophenyl)-1-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-methoxy-5-nitrophenyl)-1-methyl-1H-pyrazole-3-carboxamide
N-(3-methoxy-5-nitrophenyl)-1-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y508-7255 |
| Compound Name: | N-(3-methoxy-5-nitrophenyl)-1-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 276.25 |
| Molecular Formula: | C12 H12 N4 O4 |
| Smiles: | Cn1ccc(C(Nc2cc(cc(c2)OC)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.5854 |
| logD: | 1.5459 |
| logSw: | -2.2827 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.947 |
| InChI Key: | KINKGSNMUZODID-UHFFFAOYSA-N |