[1-(3-Fluoro-phenyl)-meth-(E)-ylidene]-isopropyl-amine | 46118-67-6

• 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: [1-(3-Fluoro-phenyl)-meth-(E)-ylidene]-isopropyl-amine
• CAS: 46118-67-6
• 化学式: C₁₀H₁₂FN
• 分子量: 165.21
• InChiKey: CWJVKEXDBULHNP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.65
• 重原子数：
  12.0
• 可旋转键数：
  2.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  12.36
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  [1-(3-Fluoro-phenyl)-meth-(E)-ylidene]-isopropyl-amine 在 lithium aluminium tetrahydride 作用下， 以 乙醚 为溶剂， 反应 2.0h， 生成 N-[(3-氟苯基)甲基]丙烷-2-胺
  参考文献：
  名称：

  Benzylamines: synthesis and evaluation of antimycobacterial properties

  摘要：

  The synthesis of benzylamines with various N-alkyl chains and substituents in the aromatic system as well as their evaluation on Mycobacterium tuberculosis H 37 Ra are described. The most active compounds in this test, N-methyl-3-chlorobenzylamine (19, MIC 10.2 micrograms/mL), N-methyl-3,5-dichlorobenzylamine (93, MIC 10.2 micrograms/mL), and N-butyl-3,5-difluorobenzylamine (103, MIC 6.4 micrograms/mL), also exhibited a marked inhibitory effect on Mycobacterium marinum and Mycobacterium lufu used for the determination of antileprotic properties. The combinations of 93 with aminosalicylic acid, streptomycin, or dapsone exert marked supra-additive effects on M. tuberculosis H 37 Ra.

  DOI：

  10.1021/jm00375a005
• 作为产物：
  描述：

  异丙胺 、 3-氟苯甲醛 反应 1.0h， 生成 [1-(3-Fluoro-phenyl)-meth-(E)-ylidene]-isopropyl-amine
  参考文献：
  名称：

  Benzylamines: synthesis and evaluation of antimycobacterial properties

  摘要：

  The synthesis of benzylamines with various N-alkyl chains and substituents in the aromatic system as well as their evaluation on Mycobacterium tuberculosis H 37 Ra are described. The most active compounds in this test, N-methyl-3-chlorobenzylamine (19, MIC 10.2 micrograms/mL), N-methyl-3,5-dichlorobenzylamine (93, MIC 10.2 micrograms/mL), and N-butyl-3,5-difluorobenzylamine (103, MIC 6.4 micrograms/mL), also exhibited a marked inhibitory effect on Mycobacterium marinum and Mycobacterium lufu used for the determination of antileprotic properties. The combinations of 93 with aminosalicylic acid, streptomycin, or dapsone exert marked supra-additive effects on M. tuberculosis H 37 Ra.

  DOI：

  10.1021/jm00375a005

文献信息

• Microwave accelerated Castagnoli-Cushman reaction: Synthesis of novel 6,7,8,9-tetrahydropyrido[3′,2′:4,5]pyrrolo[1,2-a]pyrazines
  作者：Devaiah Vytla、Parinita Shaw、Rajeswari Velayuthaperumal、Jithendra Emmadi、Arvind Mathur、Amrita Roy

  DOI：10.1016/j.tetlet.2021.152943

  日期：2021.3

  acetic anhydride as a dehydrating agent was significantly accelerated by microwave irradiation. The reaction conditions offer a convenient preparation of novel 6,7,8,9-tetrahydropyrido[3′,2′:4,5]pyrrolo[1,2-a]pyrazines in moderate to good yields with good trans stereoselectivity.

  使用乙酸酐作为脱水剂，各种氮杂吲哚二羧酸与亚胺的Castagnoli-Cushman反应可通过微波辐射显着加速。反应条件提供了方便的制备新型6,7,8,9-四氢吡啶并[3'，2'：4,5]吡咯并[1,2- a ]吡嗪的良好收率和良好的反式立体选择性。