CAS 877173-82-5

1,1-Dimethylethyl 3-(3-bromo-7-chloropyrazolo[1,5-a]pyrimidin-5-yl)-1-piperidinecarboxylate

Description:

1,1-Dimethylethyl 3-(3-bromo-7-chloropyrazolo[1,5-a]pyrimidin-5-yl)-1-piperidinecarboxylate, identified by its CAS number 877173-82-5, is a chemical compound characterized by its complex structure, which includes a piperidine ring and a pyrazolo-pyrimidine moiety. This compound features a tert-butyl group (1,1-dimethylethyl) that enhances its lipophilicity, potentially influencing its biological activity and solubility. The presence of bromine and chlorine substituents on the pyrazolo-pyrimidine structure may impart unique electronic properties and reactivity, making it of interest in medicinal chemistry. The ester functional group in the piperidinecarboxylate portion suggests potential for hydrolysis and reactivity with nucleophiles. Overall, this compound may exhibit pharmacological properties, and its structural features could be relevant in the development of therapeutic agents, particularly in targeting specific biological pathways. Further studies would be necessary to elucidate its specific biological activities and potential applications.

Formula: C₁₆H₂₀BrClN₄O₂

InChI: InChI=1S/C16H20BrClN4O2/c1-16(2,3)24-15(23)21-6-4-5-10(9-21)12-7-13(18)22-14(20-12)11(17)8-19-22/h7-8,10H,4-6,9H2,1-3H3

InChI key: InChIKey=ZAROUHNRHVFYFP-UHFFFAOYSA-N

SMILES: ClC=1N2C(N=C(C1)C3CN(C(OC(C)(C)C)=O)CCC3)=C(Br)C=N2

Synonyms:

• 1,1-Dimethylethyl 3-(3-bromo-7-chloropyrazolo[1,5-a]pyrimidin-5-yl)-1-piperidinecarboxylate
• 1-Piperidinecarboxylic acid, 3-(3-bromo-7-chloropyrazolo[1,5-a]pyrimidin-5-yl)-, 1,1-dimethylethyl ester