(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methanamine | 1240528-83-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并吡啶类
• 英文名称: (5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methanamine
• 英文别名: 5H,6H,7H,8H-imidazo[1,2-a]pyridin-2-ylmethanamine；5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylmethanamine
• CAS: 1240528-83-9
• 化学式: C₈H₁₃N₃
• mdl: MFCD16622053
• 分子量: 151.211
• InChiKey: WUWAAVDRLMQLJM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.4
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.625
• 拓扑面积：
  43.8
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  ethyl 2-[(3-nitrophenyl)amino]-2-oxoacetate 、 (5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methanamine 以 乙腈 为溶剂， 反应 6.0h， 以268 mg的产率得到N¹-(3-nitrophenyl)-N²-((5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl)oxamide
  参考文献：
  名称：

  2,2,2-Trifluoroethyl Chlorooxoacetate—Universal Reagent for One-Pot Parallel Synthesis of N¹-Aryl-N²-alkyl-Substituted Oxamides

  摘要：

  A one-pot parallel synthesis of N-1-aryl-N-2-alkyl-substituted oxamides with 2,2,2-trifluoroethyl chlorooxoacetate was developed. The synthesis of a library of 45 oxamides revealed higher efficiency of this reagent over the known ethyl chlorooxoacetate. The reagent was successfully used to prepare the known oxamide-containing HIV entry inhibitors.

  DOI：

  10.1021/acscombsci.5b00091

文献信息

• [EN] ARYL SULFONAMIDES AS SMALL MOLECULE STAT3 INHIBITORS<br/>[FR] ARYLSULFONAMIDES UTILISÉS EN TANT QU'INHIBITEURS DE STAT3 À PETITES MOLÉCULES
  申请人：UNIV HAWAII

  公开号：WO2021016333A1

  公开（公告）日：2021-01-28

  The present disclosure provides pharmaceutical compositions comprising aryl sulfonamide Stat3 small molecule inhibitors and certain pharmaceutically acceptable salts thereof, and methods of their use for treating cancer.

  本公开提供了含有芳基磺酰胺Stat3小分子抑制剂及其某些药用可接受盐的药物组合物，并其治疗癌症的使用方法。
• 2,2,2-Trifluoroethyl Chlorooxoacetate—Universal Reagent for One-Pot Parallel Synthesis of <i>N</i>¹-Aryl-<i>N</i>²-alkyl-Substituted Oxamides
  作者：Andrey V. Bogolubsky、Yurii S. Moroz、Pavel K. Mykhailiuk、Sergey E. Pipko、Anton V. Zhemera、Anzhelika I. Konovets、Olena O. Stepaniuk、Inna S. Myronchuk、Yurii V. Dmytriv、Roman A. Doroschuk、Olga A. Zaporozhets、Andrey Tolmachev

  DOI：10.1021/acscombsci.5b00091

  日期：2015.10.12

  A one-pot parallel synthesis of N-1-aryl-N-2-alkyl-substituted oxamides with 2,2,2-trifluoroethyl chlorooxoacetate was developed. The synthesis of a library of 45 oxamides revealed higher efficiency of this reagent over the known ethyl chlorooxoacetate. The reagent was successfully used to prepare the known oxamide-containing HIV entry inhibitors.