2-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl}acetamide
Chemical Structure Depiction of
2-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl}acetamide
2-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl}acetamide
Compound characteristics
| Compound ID: | 8005-9381 |
| Compound Name: | 2-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl}acetamide |
| Molecular Weight: | 465.34 |
| Molecular Formula: | C19 H14 F3 N5 O6 |
| Smiles: | Cc1cc(nn1CC(Nc1cc(cc(c1)Oc1cccc(c1)C(F)(F)F)[N+]([O-])=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0425 |
| logD: | 4.0413 |
| logSw: | -4.1781 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.291 |
| InChI Key: | XGNYHHQBGOBRLH-UHFFFAOYSA-N |