N-[3-(4-methylphenoxy)-5-nitrophenyl]-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-[3-(4-methylphenoxy)-5-nitrophenyl]-2-(4-nitro-1H-pyrazol-1-yl)acetamide
N-[3-(4-methylphenoxy)-5-nitrophenyl]-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | Y501-6061 |
| Compound Name: | N-[3-(4-methylphenoxy)-5-nitrophenyl]-2-(4-nitro-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 397.35 |
| Molecular Formula: | C18 H15 N5 O6 |
| Smiles: | Cc1ccc(cc1)Oc1cc(cc(c1)[N+]([O-])=O)NC(Cn1cc(cn1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8301 |
| logD: | 3.8292 |
| logSw: | -3.8223 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.404 |
| InChI Key: | RSRPWXDXBKOVQM-UHFFFAOYSA-N |