N-(4-chloro-3-nitrophenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(4-chloro-3-nitrophenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
N-(4-chloro-3-nitrophenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-1498 |
| Compound Name: | N-(4-chloro-3-nitrophenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 348.67 |
| Molecular Formula: | C12 H8 Cl F3 N4 O3 |
| Smiles: | Cn1c(cc(C(F)(F)F)n1)C(Nc1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7107 |
| logD: | 2.0951 |
| logSw: | -3.6457 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.926 |
| InChI Key: | MDHAMQBWXRBOHS-UHFFFAOYSA-N |