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CAS 71089-74-2

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1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane

Description:
1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane is a complex organic compound characterized by its tetracyclic structure, which includes four nitrogen atoms integrated into a macrocyclic framework. This compound features sulfonyl groups attached to 4-methylphenyl moieties, enhancing its solubility and reactivity. The presence of multiple sulfonyl groups contributes to its potential as a ligand in coordination chemistry, where it can interact with metal ions, forming stable complexes. The tetraazacyclotetradecane backbone provides a rigid structure, which can influence the compound's conformational properties and stability. Additionally, the bulky 4-methylphenyl groups may impart steric hindrance, affecting its reactivity and interaction with other molecules. This compound may exhibit interesting properties such as selective binding, catalytic activity, or potential applications in materials science and medicinal chemistry, particularly in drug delivery systems or as a scaffold for designing new therapeutic agents. Its unique structural features make it a subject of interest in various fields of chemical research.
Formula:C38H48N4O8S4
InChI:InChI=1S/C38H48N4O8S4/c1-31-7-15-35(16-8-31)51(43,44)39-23-5-24-41(53(47,48)37-19-11-33(3)12-20-37)29-30-42(54(49,50)38-21-13-34(4)14-22-38)26-6-25-40(28-27-39)52(45,46)36-17-9-32(2)10-18-36/h7-22H,5-6,23-30H2,1-4H3
InChI key:InChIKey=OVVMBINCTWKHOS-UHFFFAOYSA-N
SMILES:S(=O)(=O)(N1CCN(S(=O)(=O)C2=CC=C(C)C=C2)CCCN(S(=O)(=O)C3=CC=C(C)C=C3)CCN(S(=O)(=O)C4=CC=C(C)C=C4)CCC1)C5=CC=C(C)C=C5
Synonyms:
  • 1,4,8,11-Tetraazacyclotetradecane, 1,4,8,11-Tetrakis[(4-Methylphenyl)Sulfonyl]-
  • 1,4,8,11-Tetraazacyclotetradecane, 1,4,8,11-tetrakis(p-tolylsulfonyl)-
  • 1,4,8,11-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,8,11-tetraazacyclotetradecane
  • 1,4,8,11-Tetratosyl-1,4,8,11-tetraazacyclotetradecane
  • 1,4,8,11-tetrakis-(4-methylphenyl)sulfonyl-1,4,8,11-tetrazacyclotetradecane
  • Plerixafor Impurity 42
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