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CAS 1417794-57-0

:

1,1-Dimethylethyl 4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-1-piperidinecarboxylate

Description:
1,1-Dimethylethyl 4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-1-piperidinecarboxylate, identified by its CAS number 1417794-57-0, is a chemical compound characterized by its complex structure, which includes a piperidine ring and a pyridine moiety. The presence of a trifluoromethyl group and a chloro substituent on the pyridine enhances its lipophilicity and may influence its biological activity. This compound is likely to exhibit significant polar characteristics due to the presence of the ether and carboxylate functional groups. Its molecular structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, where such substituents can modulate pharmacokinetic properties. Additionally, the steric hindrance introduced by the dimethyl groups may affect the compound's reactivity and interaction with biological targets. As with many synthetic organic compounds, safety and handling precautions are essential, given the potential toxicity associated with halogenated and fluorinated compounds.
Formula:C16H20ClF3N2O3
InChI:InChI=1S/C16H20ClF3N2O3/c1-15(2,3)25-14(23)22-6-4-11(5-7-22)24-13-12(17)8-10(9-21-13)16(18,19)20/h8-9,11H,4-7H2,1-3H3
InChI key:InChIKey=OCCRBHFNTBZJHN-UHFFFAOYSA-N
SMILES:O(C1=C(Cl)C=C(C(F)(F)F)C=N1)C2CCN(C(OC(C)(C)C)=O)CC2
Synonyms:
  • 1,1-Dimethylethyl 4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-1-piperidinecarboxylate
  • 1-Piperidinecarboxylic acid, 4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-, 1,1-dimethylethyl ester
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