4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-{3-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}benzamide
Chemical Structure Depiction of
4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-{3-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}benzamide
4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-{3-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}benzamide
Compound characteristics
| Compound ID: | Y502-9541 |
| Compound Name: | 4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-{3-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}benzamide |
| Molecular Weight: | 496.88 |
| Molecular Formula: | C21 H20 Cl F3 N6 O3 |
| Smiles: | C(CNC(c1ccc(Cn2cc(c(n2)[N+]([O-])=O)[Cl])cc1)=O)Cn1c(cc(C(F)(F)F)n1)C1CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.3188 |
| logD: | 3.3188 |
| logSw: | -3.7638 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.549 |
| InChI Key: | FXYRYZWOVTZYJJ-UHFFFAOYSA-N |