2-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-[4-(trifluoromethoxy)phenyl]benzamide
Chemical Structure Depiction of
2-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-[4-(trifluoromethoxy)phenyl]benzamide
2-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-[4-(trifluoromethoxy)phenyl]benzamide
Compound characteristics
| Compound ID: | Y502-1626 |
| Compound Name: | 2-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-[4-(trifluoromethoxy)phenyl]benzamide |
| Molecular Weight: | 406.32 |
| Molecular Formula: | C18 H13 F3 N4 O4 |
| Smiles: | C(c1ccccc1C(Nc1ccc(cc1)OC(F)(F)F)=O)n1cc(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0577 |
| logD: | 4.0573 |
| logSw: | -4.2657 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.154 |
| InChI Key: | WUICSDDYUOKJNW-UHFFFAOYSA-N |