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CAS 99832-61-8

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Methyl 3-(4-chlorophenyl)-4,5-dihydro-4-methyl-1-[[[4-(trifluoromethyl)phenyl]amino]carbonyl]-1H-pyrazole-4-carboxylate

Description:
Methyl 3-(4-chlorophenyl)-4,5-dihydro-4-methyl-1-[[[4-(trifluoromethyl)phenyl]amino]carbonyl]-1H-pyrazole-4-carboxylate, with CAS number 99832-61-8, is a synthetic organic compound characterized by its complex structure, which includes a pyrazole ring and various functional groups such as a carboxylate ester and an amide. This compound typically exhibits moderate to high lipophilicity due to the presence of aromatic rings and halogen substituents, which can influence its solubility and bioactivity. The chlorophenyl and trifluoromethyl groups contribute to its potential as a pharmacophore in medicinal chemistry, possibly enhancing its interaction with biological targets. The compound may also display interesting pharmacological properties, making it a candidate for further research in drug development. Its synthesis and characterization would involve standard organic chemistry techniques, including purification methods such as recrystallization or chromatography. Safety and handling precautions should be observed due to the presence of halogenated compounds, which can pose environmental and health risks.
Formula:C20H17ClF3N3O3
InChI:InChI=1S/C20H17ClF3N3O3/c1-19(17(28)30-2)11-27(26-16(19)12-3-7-14(21)8-4-12)18(29)25-15-9-5-13(6-10-15)20(22,23)24/h3-10H,11H2,1-2H3,(H,25,29)
InChI key:InChIKey=NWYXCHPAIGQKNN-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1(C)C(=NN(C(NC2=CC=C(C(F)(F)F)C=C2)=O)C1)C3=CC=C(Cl)C=C3
Synonyms:
  • RH 3421
  • 1H-Pyrazole-4-carboxylic acid, 3-(4-chlorophenyl)-4,5-dihydro-4-methyl-1-[[[4-(trifluoromethyl)phenyl]amino]carbonyl]-, methyl ester
  • Methyl 3-(4-chlorophenyl)-4,5-dihydro-4-methyl-1-[[[4-(trifluoromethyl)phenyl]amino]carbonyl]-1H-pyrazole-4-carboxylate
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