(S)-2-(((3-nitropyridin-2-yl)thio)oxy)-3-phenylpropanoic acid | 77800-32-9

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 苯丙酸
• 英文名称: (S)-2-(((3-nitropyridin-2-yl)thio)oxy)-3-phenylpropanoic acid
• 英文别名: (2S)-2-(3-nitropyridin-2-yl)sulfanyloxy-3-phenylpropanoic acid
• CAS: 77800-32-9
• 化学式: C₁₄H₁₂N₂O₅S
• 分子量: 320.326
• InChiKey: IADQHJAUHAUPDA-LBPRGKRZSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  22
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  131
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  3-硝基-2-吡啶硫酰氯 、 L-(-)-3-苯基乳酸 在 三乙胺 作用下， 以 二氯甲烷 、 乙酸乙酯 为溶剂， 反应 1.0h， 以72%的产率得到(S)-2-(((3-nitropyridin-2-yl)thio)oxy)-3-phenylpropanoic acid
  参考文献：
  名称：

  Matsueda, Rei; Kaiser, Emil Thomas, Heterocycles, 1981, vol. 15, # 2, p. 1089 - 1092

  摘要：

  DOI：

文献信息

• Selective disulfidation reagent using nitrogen-containing compound and method for producing disulfide-containing compound
  申请人：Tokyo University of Pharmacy & Life Sciences

  公开号：US10829512B2

  公开（公告）日：2020-11-10

  The present invention provides a means capable of selectively introducing a disulfide bond with respect to two free thiol groups located in a molecule of an organic compound such as a peptide, or the like, in a short time by a simple treatment and also by a chemically stable method. A nitrogen-containing compound represented by Chemical Formula 1 below or a salt thereof: The symbols shown in Chemical Formula 1 are the same as defined in the specification.

  本发明提供了一种能够通过简单的处理和化学稳定的方法，在短时间内有选择性地引入二硫键到有机化合物分子中的两个游离巯基（如肽等）的手段。该手段涉及一种化学式1所表示的含氮化合物或其盐，化学式1中的符号与说明书中定义的相同。
• SELECTIVE DISULFIDATION REAGENT USING NITROGEN-CONTAINING COMPOUND AND METHOD FOR PRODUCING DISULFIDE-CONTAINING COMPOUND
  申请人：Tokyo University of Pharmacy & Life Sciences

  公开号：US20190169228A1

  公开（公告）日：2019-06-06

  The present invention provides a means capable of selectively introducing a disulfide bond with respect to two free thiol groups located in a molecule of an organic compound such as a peptide, or the like, in a short time by a simple treatment and also by a chemically stable method. A nitrogen-containing compound represented by Chemical Formula 1 below or a salt thereof: The symbols shown in Chemical Formula 1 are the same as defined in the specification.
• Matsueda, Rei; Kaiser, Emil Thomas, Heterocycles, 1981, vol. 15, # 2, p. 1089 - 1092
  作者：Matsueda, Rei、Kaiser, Emil Thomas

  DOI：——

  日期：——