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CAS 1227955-15-8

:

1,1-Dimethylethyl 4-[2-(4-bromo-2-fluorophenoxy)ethyl]-1-piperazinecarboxylate

Description:
1,1-Dimethylethyl 4-[2-(4-bromo-2-fluorophenoxy)ethyl]-1-piperazinecarboxylate, identified by its CAS number 1227955-15-8, is a chemical compound characterized by its complex structure, which includes a piperazine ring, a carboxylate group, and a substituted phenoxy moiety. This compound features a tert-butyl group (1,1-dimethylethyl) that contributes to its steric bulk, potentially influencing its biological activity and solubility. The presence of bromine and fluorine substituents on the aromatic ring may enhance its lipophilicity and alter its electronic properties, which can affect interactions with biological targets. The piperazine moiety is often associated with pharmacological activity, making this compound of interest in medicinal chemistry. Its synthesis and characterization would typically involve standard organic reactions, and its properties could be evaluated through various analytical techniques such as NMR, mass spectrometry, and chromatography. Overall, this compound's unique structural features suggest potential applications in drug development or as a research tool in biochemistry.
Formula:C17H24BrFN2O3
InChI:InChI=1S/C17H24BrFN2O3/c1-17(2,3)24-16(22)21-8-6-20(7-9-21)10-11-23-15-5-4-13(18)12-14(15)19/h4-5,12H,6-11H2,1-3H3
InChI key:InChIKey=ITYGXRPMFPPRMF-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1CCN(CCOC2=C(F)C=C(Br)C=C2)CC1
Synonyms:
  • 1-Piperazinecarboxylic acid, 4-[2-(4-bromo-2-fluorophenoxy)ethyl]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-[2-(4-bromo-2-fluorophenoxy)ethyl]-1-piperazinecarboxylate
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