N-(4-methoxyphenyl)-2-oxo-2-(phenylamino)acetohydrazonoyl chloride | 38010-32-1

• 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: N-(4-methoxyphenyl)-2-oxo-2-(phenylamino)acetohydrazonoyl chloride
• CAS: 38010-32-1
• 化学式: C₁₅H₁₄ClN₃O₂
• 分子量: 303.748
• InChiKey: XZCSSJJUEBSMRF-UHFFFAOYSA-N

物化性质

• 密度：
  1.24±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  21.0
• 可旋转键数：
  5.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  62.72
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  N-(4-methoxyphenyl)-2-oxo-2-(phenylamino)acetohydrazonoyl chloride 在 sodium nitrate 、 水 、 三乙胺 作用下， 以 1,4-二氧六环 为溶剂， 生成 2-[N'-(4-Methoxy-phenyl)-hydrazino]-2-oxo-N-phenyl-acetamide 、 1,4-Bis-(4-methoxy-phenyl)-1,4-dihydro-[1,2,4,5]tetrazine-3,6-dicarboxylic acid bis-phenylamide
  参考文献：
  名称：

  Shawali, Ahmad S.; Elwan, Nehal M.; Awad, Ahmad M., Journal of Chemical Research, Miniprint, 1997, # 8, p. 1870 - 1881

  摘要：

  DOI：

文献信息

• Synthesis and Antitumor Activity of 1,3,4-Thiadiazole Derivatives Bearing Coumarine Ring
  作者：Sobhi M. Gomha、Hassan M. Abdel-aziz

  DOI：10.3987/com-14-13146

  日期：——

  In the present study, preparation of a novel series of N'-(3,5-diphenyl-1,3,4-thiadiazol-2(3H)-ylidene)-2-oxo-2H-chromene-3-carbohydrazide (8 a-m) was prepared by two methods via the reaction of hydrazonoyl halides with methyl 2-(2-oxo-2H-chromene-3-carbonyl)hydrazinecarbodithioate or 3-(5-mercapto-1,3,4-oxadiazol-2-y1)-2H-chromen-2-one. Structures of the newly synthesized compounds were elucidated on the basis of elemental analyses and spectral data. All the newly synthesized compounds have been evaluated for their antitumor activity against a liver carcinoma cell line HEPG2-1. Also, their structure activity relationship (SAR) was studied. Many of the tested compounds showed moderate to high anticancer activity with respective to doxorubicin as a reference drug.