3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}benzamide
Chemical Structure Depiction of
3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}benzamide
3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}benzamide
Compound characteristics
| Compound ID: | Y501-7817 |
| Compound Name: | 3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}benzamide |
| Molecular Weight: | 548.47 |
| Molecular Formula: | C25 H21 F5 N6 O3 |
| Smiles: | Cc1c(c(C)n(Cc2c(c(c(c(c2F)F)F)F)F)n1)NC(c1cccc(Cn2c(C)c(c(C)n2)[N+]([O-])=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.335 |
| logD: | 3.3272 |
| logSw: | -3.7939 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.277 |
| InChI Key: | NHWZXPDKPUHTPG-UHFFFAOYSA-N |