N-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]ethyl]-N-[(E)-2,2-dimethylpropylideneamino]-2-nitrobenzenesulfonamide | 1026313-08-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: N-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]ethyl]-N-[(E)-2,2-dimethylpropylideneamino]-2-nitrobenzenesulfonamide
• CAS: 1026313-08-5
• 化学式: C₃₀H₃₁ClN₄O₆S
• 分子量: 611.118
• InChiKey: QNNCOQPHXZBLLW-BIZUNTBRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.8
• 重原子数：
  42
• 可旋转键数：
  9
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  135
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  N-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]ethyl]-N-[(E)-2,2-dimethylpropylideneamino]-2-nitrobenzenesulfonamide 以 2,2,2-三氟乙醇 、 水 为溶剂， 反应 11.0h， 以107 mg的产率得到2,2-dimethylpropionic acid N'-{2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]ethyl} hydrazide
  参考文献：
  名称：

  N-Isopropylidene-N‘-2-nitrobenzenesulfonyl Hydrazine, a Reagent for Reduction of Alcohols via the Corresponding Monoalkyl Diazenes

  摘要：

  The reagent N-isopropylidene-N'-2-nitrobenzenesulfonyl hydrazine (IPNBSH) is used in the reduction of alcohols via the loss of dinitrogen from transiently formed monoalkyl diazene intermediates accessed by sequential Mitsunobu displacement, hydrolysis, and fragmentation under mild reaction conditions.

  DOI：

  10.1021/jo062325p
• 作为产物：
  描述：

  2-硝基苯磺酰肼 在 三苯基膦 、 偶氮二甲酸二乙酯 作用下， 以 四氢呋喃 、 叔丁醇 为溶剂， 反应 0.5h， 生成 N-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]ethyl]-N-[(E)-2,2-dimethylpropylideneamino]-2-nitrobenzenesulfonamide
  参考文献：
  名称：

  N-Isopropylidene-N‘-2-nitrobenzenesulfonyl Hydrazine, a Reagent for Reduction of Alcohols via the Corresponding Monoalkyl Diazenes

  摘要：

  The reagent N-isopropylidene-N'-2-nitrobenzenesulfonyl hydrazine (IPNBSH) is used in the reduction of alcohols via the loss of dinitrogen from transiently formed monoalkyl diazene intermediates accessed by sequential Mitsunobu displacement, hydrolysis, and fragmentation under mild reaction conditions.

  DOI：

  10.1021/jo062325p

文献信息

• <i>N</i>-Isopropylidene-<i>N</i>‘-2-nitrobenzenesulfonyl Hydrazine, a Reagent for Reduction of Alcohols via the Corresponding Monoalkyl Diazenes
  作者：Mohammad Movassaghi、Omar K. Ahmad

  DOI：10.1021/jo062325p

  日期：2007.3.1

  The reagent N-isopropylidene-N'-2-nitrobenzenesulfonyl hydrazine (IPNBSH) is used in the reduction of alcohols via the loss of dinitrogen from transiently formed monoalkyl diazene intermediates accessed by sequential Mitsunobu displacement, hydrolysis, and fragmentation under mild reaction conditions.