ethyl 4-(pyridin-3-ylamino)benzoate

• 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: ethyl 4-(pyridin-3-ylamino)benzoate
• 英文别名: Ethyl 4-[(pyridin-3-yl)amino]benzoate
• 化学式: C₁₄H₁₄N₂O₂
• 分子量: 242.277
• InChiKey: CWOYNCGZCWQQEG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  18
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  51.2
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  3-氨基吡啶 、 4-溴苯甲酸乙酯 在 tris(dibenzylideneacetone)dipalladium (0) sodium phenoxide 、 4,5-双二苯基膦-9,9-二甲基氧杂蒽 作用下， 以 1,4-二氧六环 为溶剂， 反应 2.0h， 以81%的产率得到ethyl 4-(pyridin-3-ylamino)benzoate
  参考文献：
  名称：

  以苯酚钠为化学计量碱，钯催化杂芳胺与芳基卤的偶联

  摘要：

  在微波和标准热条件下，杂芳基胺与具有催化作用的 Pd 2 (dba) 3 和 Xantphos 有效偶联（在两小时内）与芳基卤化物以提供相应的联芳基胺。使用可溶于有机物的苯酚钠 (NaOPh) 作为化学计量碱可促进多种底物以优异的产率轻松偶联。

  DOI：

  10.1055/s-2007-985597

文献信息

• Palladium-Catalyzed Couplings of Heteroaryl Amines with Aryl Halides Using Sodium Phenolate as the Stoichiometric Base
  作者：James Schulte II、Scott Tweedie

  DOI：10.1055/s-2007-985597

  日期：2007.9

  Heteroaryl amines are efficiently coupled (in two hours) to aryl halides with catalytic Pd 2 (dba) 3 and Xantphos to provide the corresponding biaryl amines under microwave and standard thermal conditions. The use of organic-soluble sodium phenolate (NaOPh) as the stoichiometric base promotes facile coupling of a variety of substrates in excellent yields.

  在微波和标准热条件下，杂芳基胺与具有催化作用的 Pd 2 (dba) 3 和 Xantphos 有效偶联（在两小时内）与芳基卤化物以提供相应的联芳基胺。使用可溶于有机物的苯酚钠 (NaOPh) 作为化学计量碱可促进多种底物以优异的产率轻松偶联。
• Compounds and methods of use
  申请人：Ferro Therapeutics, Inc.

  公开号：US11040964B2

  公开（公告）日：2021-06-22

  This present disclosure relates to compounds with ferroptosis inducing activity, a method of treating a subject with cancer with the compounds, and combination treatments with a second therapeutic agent.

  本公开涉及具有铁突变诱导活性的化合物、用这些化合物治疗癌症患者的方法以及与第二种治疗剂的联合治疗。
• COMPOUNDS WITH FERROPTOSIS INDUCING ACTIVITY AND METHODS OF THEIR USE
  申请人：Ferro Therapeutics, Inc.

  公开号：EP3931183A1

  公开（公告）日：2022-01-05
• COMPOUNDS AND METHODS OF USE
  申请人：Ferro Therapeutics, Inc.

  公开号：US20200299283A1

  公开（公告）日：2020-09-24

  This present disclosure relates to compounds with ferroptosis inducing activity, a method of treating a subject with cancer with the compounds, and combination treatments with a second therapeutic agent.
• A Multiligand Based Pd Catalyst for C−N Cross-Coupling Reactions
  作者：Brett P. Fors、Stephen L. Buchwald

  DOI：10.1021/ja108074t

  日期：2010.11.17

  An alternative approach to catalyst development, which led to a Pd catalyst based on two biarylphosphine ligands for C-N cross-coupling reactions, is reported. By effectively being able to take the form of multiple catalysts this system manifests the best properties that catalysts based on either of the two ligands exhibit separately and displays the highest reactivity and substrate scope of any system that has been reported to date for these reactions.