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CAS 2197053-86-2

:

Methyl 3-[[[[2-methyl-6-(trifluoromethyl)-3-pyridinyl]amino]carbonyl]amino]benzoate

Description:
Methyl 3-[[[[2-methyl-6-(trifluoromethyl)-3-pyridinyl]amino]carbonyl]amino]benzoate, identified by its CAS number 2197053-86-2, is a synthetic organic compound characterized by its complex molecular structure. It features a methyl ester functional group, which contributes to its solubility in organic solvents. The presence of a pyridine ring, specifically substituted with a trifluoromethyl group, enhances its electronic properties and may influence its biological activity. The compound also contains multiple amine and carbonyl functionalities, indicating potential reactivity and interactions in various chemical environments. Its molecular design suggests applications in medicinal chemistry, possibly as a pharmaceutical agent or a precursor in drug development. The trifluoromethyl group is known for imparting unique properties, such as increased lipophilicity and metabolic stability. Overall, this compound exemplifies the intricate balance of functional groups that can lead to diverse chemical behavior and potential therapeutic applications.
Formula:C16H14F3N3O3
InChI:InChI=1S/C16H14F3N3O3/c1-9-12(6-7-13(20-9)16(17,18)19)22-15(24)21-11-5-3-4-10(8-11)14(23)25-2/h3-8H,1-2H3,(H2,21,22,24)
InChI key:InChIKey=MOQUCZTWQICTQY-UHFFFAOYSA-N
SMILES:N(C(NC1=CC(C(OC)=O)=CC=C1)=O)C2=C(C)N=C(C(F)(F)F)C=C2
Synonyms:
  • Methyl 3-[[[[2-methyl-6-(trifluoromethyl)-3-pyridinyl]amino]carbonyl]amino]benzoate
  • Benzoic acid, 3-[[[[2-methyl-6-(trifluoromethyl)-3-pyridinyl]amino]carbonyl]amino]-, methyl ester
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