2,6-bis{[(pyrid-2-ylmethyl)(tosyl)amino]methyl}pyridine | 90719-78-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2,6-bis{[(pyrid-2-ylmethyl)(tosyl)amino]methyl}pyridine
• 英文别名: 2,6-bis[(N-tosyl(2-pyridylmethyl)amino)methyl]pyridine；N,N'-ditosyl-2,6-bis[(2-pyridylmethylamino)methyl]pyridine；4-methyl-N-[[6-[[(4-methylphenyl)sulfonyl-(pyridin-2-ylmethyl)amino]methyl]pyridin-2-yl]methyl]-N-(pyridin-2-ylmethyl)benzenesulfonamide
• CAS: 90719-78-1
• 化学式: C₃₃H₃₃N₅O₄S₂
• 分子量: 627.788
• InChiKey: UECMDARFCKNPFD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  44
• 可旋转键数：
  12
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  130
• 氢给体数：
  0
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  2,6-bis{[(pyrid-2-ylmethyl)(tosyl)amino]methyl}pyridine 在 硫酸 作用下， 反应 3.0h， 以94%的产率得到2,6-bis([(pyrid-2-ylmethyl)amino]methyl)pyridine
  参考文献：
  名称：

  Syntheses of Zinc Complexes with Multidentate Nitrogen Ligands: New Catalysts for Aldol Reactions

  摘要：

  DOI：

  10.1002/1099-0682(200212)2002:12<3284::aid-ejic3284>3.0.co;2-6
• 作为产物：
  描述：

  2,6-吡啶二甲醇 在 氢氧化钾 、 四丁基溴化铵 、 氢溴酸 作用下， 以 二氯甲烷 为溶剂， 反应 29.0h， 生成 2,6-bis{[(pyrid-2-ylmethyl)(tosyl)amino]methyl}pyridine
  参考文献：
  名称：

  Syntheses of Zinc Complexes with Multidentate Nitrogen Ligands: New Catalysts for Aldol Reactions

  摘要：

  DOI：

  10.1002/1099-0682(200212)2002:12<3284::aid-ejic3284>3.0.co;2-6

文献信息

• Ligand tuning of single-site manganese-based catalytic antioxidants with dual superoxide dismutase and catalase activity
  作者：Michaela Grau、Francesco Rigodanza、Andrew J. P. White、Antonio Sorarù、Mauro Carraro、Marcella Bonchio、George J. P. Britovsek

  DOI：10.1039/c4cc00758a

  日期：——

  A bio-inspired manganese(ii) complex with a linear pentadentate ligand framework containing soft sulfur donors and an alternating NSNSN binding motif displays excellent dual CAT/SOD-like antioxidant activity with high turnover efficiency and good operation stability in an aqueous environment.

  具有线性五齿配体骨架的生物启发型锰（ii）配合物，含软硫供体和交替的NSNSN结合基序，具有出色的双CAT / SOD类抗氧化活性，在水环境中具有高转换效率和良好的操作稳定性。
• Syntheses of Zinc Complexes with Multidentate Nitrogen Ligands: New Catalysts for Aldol Reactions
  作者：Tamis Darbre、Christian Dubs、Eduard Rusanov、Helen Stoeckli-Evans

  DOI：10.1002/1099-0682(200212)2002:12<3284::aid-ejic3284>3.0.co;2-6

  日期：2002.12
• Synthesis of novel chiral polyamide macrocycles containing pyridyl side-arms and their molecular recognition properties
  作者：Xiao Chen、Da-Ming Du、Wen-Ting Hua

  DOI：10.1016/s0957-4166(03)00173-3

  日期：2003.4

  Seven novel C-2-symmetrical macrocycles containing pyridyl units have been prepared by the cyclic condensation of homochiral diamide intermediates with 2,6-pyridinedicarbonyl dichloride under high dilution at room temperature. The molecular recognition of these homochiral macrocycles for amino acid derivatives has been characterized by various spectroscopic methods such as IR, FAB-MS, fluorescence and UV-vis. The macrocycle 11 exhibited significant chiral recognition towards the enantiomers Of D- and L-alanine methyl ester hydrochlorides for which association constants have been determined. Molecular modeling was also used to simulate the interaction mode between the hosts and the guests. (C) 2003 Elsevier Science Ltd. All rights reserved.