4,7,13,16-tetraoxa-21-thia-1,10-diazabicyclo[8.8.5]nonadecane 21,21-dioxide

• 分子结构分类: 有机化合物 - 有机硫化合物 - 磺酰类
• 英文名称: 4,7,13,16-tetraoxa-21-thia-1,10-diazabicyclo[8.8.5]nonadecane 21,21-dioxide
• 英文别名: 4,7,13,16-Tetraoxa-21lambda6-thia-1,10-diazabicyclo[8.8.5]tricosane 21,21-dioxide；4,7,13,16-tetraoxa-21λ6-thia-1,10-diazabicyclo[8.8.5]tricosane 21,21-dioxide
• 化学式: C₁₆H₃₂N₂O₆S
• 分子量: 380.506
• InChiKey: IZLRURSEGXYZIE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.4
• 重原子数：
  25
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  85.9
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  二乙烯基砜 、 二氮杂18-冠醚-6 以 水 、 异丙醇 为溶剂， 反应 1.0h， 以97%的产率得到4,7,13,16-tetraoxa-21-thia-1,10-diazabicyclo[8.8.5]nonadecane 21,21-dioxide
  参考文献：
  名称：

  Bis-Heteronucleophilic Michael Addition to Divinyl Sulfone: A New Efficient Access to Macrocycles

  摘要：

  The Michael addition of bis(nitrogen or sulfur) nucleophiles to divinyl sulfone provides the corresponding macrocyclic adducts in good yields. The structures of some new macrocyclic sulfones are established by X-ray crystallographic analysis and NMR spectroscopy. The subsequent cleavage of benzyl or tosyl groups yields the unprotected macrocyclic sulfones.

  DOI：

  10.1002/1099-0690(200301)2003:1<54::aid-ejoc54>3.0.co;2-r

文献信息

• Bis-Heteronucleophilic Michael Addition to Divinyl Sulfone: A New Efficient Access to Macrocycles
  作者：Marie-Laure Teyssot、Martine Fayolle、Christian Philouze、Claude Dupuy

  DOI：10.1002/1099-0690(200301)2003:1<54::aid-ejoc54>3.0.co;2-r

  日期：2003.1

  The Michael addition of bis(nitrogen or sulfur) nucleophiles to divinyl sulfone provides the corresponding macrocyclic adducts in good yields. The structures of some new macrocyclic sulfones are established by X-ray crystallographic analysis and NMR spectroscopy. The subsequent cleavage of benzyl or tosyl groups yields the unprotected macrocyclic sulfones.