N-(N-(4-dimethylaminobenzylideneamino)acetamidyl)-5-nitroindazole | 1245567-26-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡唑类
• 英文名称: N-(N-(4-dimethylaminobenzylideneamino)acetamidyl)-5-nitroindazole
• 英文别名: N-[[4-(dimethylamino)phenyl]methylideneamino]-2-(5-nitroindazol-1-yl)acetamide
• CAS: 1245567-26-3
• 化学式: C₁₈H₁₈N₆O₃
• 分子量: 366.379
• InChiKey: OGXNLARFFABVRF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.16
• 重原子数：
  27.0
• 可旋转键数：
  6.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  105.66
• 氢给体数：
  1.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  N-(N-(4-dimethylaminobenzylideneamino)acetamidyl)-5-nitroindazole 、 氯乙酰氯 在 三乙胺 作用下， 以 丙酮 为溶剂， 反应 5.0h， 以65%的产率得到4-(4-dimethylaminophenyl)-3-chloro-1-[(5-nitroindazol-1-yl)acetamido]-2-oxo-azetidine
  参考文献：
  名称：

  Synthesis and Characterization of New 2-Oxo-azetidine Derivatives

  摘要：

  Several new N-[(4-aryl-3-chloro-2-oxo-azetidine)acetamidyl]-5-nitroindazoles 4a-l were synthesized from N-(arylidene amino acetamidyl)-5-nitroindazoles 3a-l. The structures of all these compounds were confirmed by infrared, H-1 NMR, C-13 NMR, and fast atom bombardment-mass spectra and also by microanalytical data.

  DOI：

  10.1080/00397911.2010.515328
• 作为产物：
  描述：

  N-(ethyl ethanoate)-5-nitroindazole 在 一水合肼 作用下， 以 1,4-二氧六环 为溶剂， 反应 9.0h， 生成 N-(N-(4-dimethylaminobenzylideneamino)acetamidyl)-5-nitroindazole
  参考文献：
  名称：

  Synthesis and Characterization of New 2-Oxo-azetidine Derivatives

  摘要：

  Several new N-[(4-aryl-3-chloro-2-oxo-azetidine)acetamidyl]-5-nitroindazoles 4a-l were synthesized from N-(arylidene amino acetamidyl)-5-nitroindazoles 3a-l. The structures of all these compounds were confirmed by infrared, H-1 NMR, C-13 NMR, and fast atom bombardment-mass spectra and also by microanalytical data.

  DOI：

  10.1080/00397911.2010.515328

文献信息

• Conventional and microwave assisted synthesis of Some new N-[(4-oxo-2-substituted aryl −1, 3-thiazolidine)-acetamidyl]-5-nitroindazoles and its antimicrobial activity
  作者：Apoorva Upadhyay、S.K. Srivastava、S.D. Srivastava

  DOI：10.1016/j.ejmech.2010.04.029

  日期：2010.9

  Several new N-[(4-oxo-2-substituted aryl-1, 3-thiazolidine)-acetamidyl]-5-nitroindazoles (4a-1) were synthesized from N-(arylidene amino acetamidyl)-5-nitroindazoles (3a-1). The reactions were carried out by both conventional as well as microwave method. The structures of these compounds were confirmed by IR, H-1 NMR, C-13 NMR, FAB-mass spectra and also by microanalytical data. The newly synthesized compounds were evaluated for their antimicrobial activity against variety of bacterial and fungal strains. The compounds 4g and 4h showed the maximum antibacterial activity (MIC 11 and 10 mu g/mL) against Escherichia coli and antifungal activity (MIC 9 and 8 mu g/mL) against Fusarium oxysporum. (C) 2010 Elsevier Masson SAS. All rights reserved.
• Synthesis and Characterization of New 2-Oxo-azetidine Derivatives
  作者：Apoorva Upadhyay、S. K. Srivastava、S. D. Srivastava

  DOI：10.1080/00397911.2010.515328

  日期：2011.9.1

  Several new N-[(4-aryl-3-chloro-2-oxo-azetidine)acetamidyl]-5-nitroindazoles 4a-l were synthesized from N-(arylidene amino acetamidyl)-5-nitroindazoles 3a-l. The structures of all these compounds were confirmed by infrared, H-1 NMR, C-13 NMR, and fast atom bombardment-mass spectra and also by microanalytical data.
• Upadhyay, Apoorva; Srivastava; Srivastava, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2011, vol. 50, # 1, p. 89 - 97
  作者：Upadhyay, Apoorva、Srivastava、Srivastava、Yadav

  DOI：——

  日期：——