N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-6046 |
| Compound Name: | N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}-1-methyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 444.32 |
| Molecular Formula: | C17 H13 F5 N6 O3 |
| Smiles: | Cc1c(c(C)n(Cc2c(c(c(c(c2F)F)F)F)F)n1)NC(c1c(cnn1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8697 |
| logD: | 1.4325 |
| logSw: | -2.3605 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.812 |
| InChI Key: | AGKVLSWEBIASFU-UHFFFAOYSA-N |