1-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-nitro-1H-pyrazole-3-carboxamide
1-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-4633 |
| Compound Name: | 1-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 438.32 |
| Molecular Formula: | C17 H13 F3 N6 O5 |
| Smiles: | COc1ccc(cc1OC)c1cc(C(F)(F)F)nc(n1)n1cc(c(C(N)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4933 |
| logD: | 2.4933 |
| logSw: | -2.8055 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 114.77 |
| InChI Key: | GFFOTZXRLOUXFM-UHFFFAOYSA-N |