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CAS 1218790-78-3

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1-(1,1-Dimethylethyl) 4-(3-borono-2-pyridinyl)-1-piperazinecarboxylate

Description:
1-(1,1-Dimethylethyl) 4-(3-borono-2-pyridinyl)-1-piperazinecarboxylate, with the CAS number 1218790-78-3, is a chemical compound characterized by its complex structure that includes a piperazine ring, a boron-containing group, and a pyridine moiety. This compound typically exhibits properties associated with both organic and organoboron chemistry, making it of interest in various applications, including medicinal chemistry and material science. The presence of the boron atom suggests potential reactivity and utility in cross-coupling reactions, which are valuable in synthesizing complex organic molecules. Additionally, the dimethyl group contributes to steric hindrance, which can influence the compound's reactivity and interaction with biological targets. The overall molecular structure may impart specific pharmacological properties, making it a candidate for further investigation in drug development. Its solubility, stability, and reactivity would depend on the surrounding conditions, such as pH and solvent, which are crucial for its application in research and industry.
Formula:C14H22BN3O4
InChI:InChI=1S/C14H22BN3O4/c1-14(2,3)22-13(19)18-9-7-17(8-10-18)12-11(15(20)21)5-4-6-16-12/h4-6,20-21H,7-10H2,1-3H3
InChI key:InChIKey=RKPZJPDCQGDUDQ-UHFFFAOYSA-N
SMILES:B(O)(O)C1=C(N=CC=C1)N2CCN(C(OC(C)(C)C)=O)CC2
Synonyms:
  • 1-(1,1-Dimethylethyl) 4-(3-borono-2-pyridinyl)-1-piperazinecarboxylate
  • 2-(4-(t-Butoxycarbonyl)piperazin-1-yl)pyridine-3-boronic acid
  • 1-Piperazinecarboxylic acid, 4-(3-borono-2-pyridinyl)-, 1-(1,1-dimethylethyl) ester
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