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CAS 913388-55-3

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1-(1,1-Dimethylethyl) 2-borono-5-[[4-[(1,1-dimethylethoxy)carbonyl]-1-piperazinyl]carbonyl]-1H-indole-1-carboxylate

Description:
The chemical substance known as 1-(1,1-Dimethylethyl) 2-borono-5-[[4-[(1,1-dimethylethoxy)carbonyl]-1-piperazinyl]carbonyl]-1H-indole-1-carboxylate, with CAS number 913388-55-3, is a complex organic compound characterized by its unique structural features. It contains an indole core, which is a bicyclic structure known for its presence in many biologically active compounds. The presence of a boron atom in the molecule suggests potential applications in medicinal chemistry, particularly in drug design and development, as boron-containing compounds can exhibit interesting reactivity and biological activity. The compound also features a dimethylethyl group and a piperazine moiety, which may contribute to its pharmacological properties. Additionally, the presence of ester and carbonyl functional groups indicates potential for further chemical reactivity and interactions. Overall, this compound's intricate structure and functional groups suggest it may have significant implications in pharmaceutical research, particularly in the development of targeted therapies.
Formula:C23H32BN3O7
InChI:InChI=1S/C23H32BN3O7/c1-22(2,3)33-20(29)26-11-9-25(10-12-26)19(28)15-7-8-17-16(13-15)14-18(24(31)32)27(17)21(30)34-23(4,5)6/h7-8,13-14,31-32H,9-12H2,1-6H3
InChI key:InChIKey=LVGLYSZJALKNOQ-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C=2C(C=C1B(O)O)=CC(C(=O)N3CCN(C(OC(C)(C)C)=O)CC3)=CC2
Synonyms:
  • 1H-Indole-1-carboxylic acid, 2-borono-5-[[4-[(1,1-dimethylethoxy)carbonyl]-1-piperazinyl]carbonyl]-, 1-(1,1-dimethylethyl) ester
  • 1-(1,1-Dimethylethyl) 2-borono-5-[[4-[(1,1-dimethylethoxy)carbonyl]-1-piperazinyl]carbonyl]-1H-indole-1-carboxylate
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