N-((1S,2S)-2-(5-tert-butyl-2-methylphenylthio)cyclohexyl)-4-methylbenzenesulfonamide | 1041382-79-9

• 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: N-((1S,2S)-2-(5-tert-butyl-2-methylphenylthio)cyclohexyl)-4-methylbenzenesulfonamide
• 英文别名: N-[(1S,2S)-2-(5-tert-butyl-2-methylphenyl)sulfanylcyclohexyl]-4-methylbenzenesulfonamide
• CAS: 1041382-79-9
• 化学式: C₂₄H₃₃NO₂S₂
• 分子量: 431.664
• InChiKey: XBHMLHKPXLSUFP-VXKWHMMOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.8
• 重原子数：
  29
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  79.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  7-(4-甲基苯基)磺酰基-7-氮杂双环[4.1.0]庚烷 、 5-叔丁基-2-甲基苯硫酚 在 奎宁 作用下， 以 氯仿 为溶剂， 生成 N-((1R,2R)-2-(5-tert-butyl-2-methylphenylthio)cyclohexyl)-4-methylbenzenesulfonamide 、 N-((1S,2S)-2-(5-tert-butyl-2-methylphenylthio)cyclohexyl)-4-methylbenzenesulfonamide
  参考文献：
  名称：

  Quinine-catalyzed enantioselective desymmetrization of meso-aziridines with benzenethiols

  摘要：

  Ring opening of meso-aziridines with benzenethiols utilizing quinine as an organocatalyst has been developed. The reaction proceeded smoothly in the presence of 10 mol % of quinine in CHCl3 to afford beta-amino sulfides in high yields and with moderate to good enantioselectivities. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2008.03.017

文献信息

• Quinine-catalyzed enantioselective desymmetrization of meso-aziridines with benzenethiols
  作者：Zhiyong Wang、Xiaoyu Sun、Shengqing Ye、Weizi Wang、Bing Wang、Jie Wu

  DOI：10.1016/j.tetasy.2008.03.017

  日期：2008.5

  Ring opening of meso-aziridines with benzenethiols utilizing quinine as an organocatalyst has been developed. The reaction proceeded smoothly in the presence of 10 mol % of quinine in CHCl3 to afford beta-amino sulfides in high yields and with moderate to good enantioselectivities. (C) 2008 Elsevier Ltd. All rights reserved.