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CAS 936250-21-4

:

1,1-Dimethylethyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-1-piperazinecarboxylate

Description:
1,1-Dimethylethyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-1-piperazinecarboxylate, with CAS number 936250-21-4, is a chemical compound characterized by its complex structure, which includes a piperazine ring, a pyridine moiety, and a boron-containing dioxaborolane group. This compound is typically utilized in medicinal chemistry and drug development due to its potential biological activity. The presence of the piperazine and pyridine rings suggests possible interactions with biological targets, making it of interest for pharmacological studies. The dimethyl group contributes to its steric properties, potentially influencing its reactivity and solubility. Additionally, the dioxaborolane group may enhance the compound's stability and facilitate specific chemical reactions, such as Suzuki coupling, which is valuable in organic synthesis. Overall, this compound exemplifies the intricate design often employed in the development of novel therapeutic agents, combining various functional groups to achieve desired chemical and biological properties.
Formula:C20H32BN3O4
InChI:InChI=1S/C20H32BN3O4/c1-18(2,3)26-17(25)24-12-10-23(11-13-24)16-14-15(8-9-22-16)21-27-19(4,5)20(6,7)28-21/h8-9,14H,10-13H2,1-7H3
InChI key:InChIKey=NQBNJXYYAKBREJ-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C=2C=C(N=CC2)N3CCN(C(OC(C)(C)C)=O)CC3
Synonyms:
  • 1,1-Dimethylethyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-1-piperazinecarboxylate
  • tert-Butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine-1-carboxylate
  • 1-Piperazinecarboxylic acid, 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-, 1,1-dimethylethyl ester
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