1-(3-Chlorophenyl)-3-[(2-naphthalen-2-yloxyacetyl)amino]thiourea | 905261-90-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 1-(3-Chlorophenyl)-3-[(2-naphthalen-2-yloxyacetyl)amino]thiourea
• CAS: 905261-90-7
• 化学式: C₁₉H₁₆ClN₃O₂S
• 分子量: 385.874
• InChiKey: ZSDGTAURQNIESO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  26
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  94.5
• 氢给体数：
  3
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-(3-Chlorophenyl)-3-[(2-naphthalen-2-yloxyacetyl)amino]thiourea 在 lithium perchlorate 作用下， 以 乙腈 为溶剂， 反应 3.0h， 以75%的产率得到
  参考文献：
  名称：

  Electrochemically initiated oxidative cyclization: a versatile route for the synthesis of 5-substituted 2-amino-1,3,4-oxadiazoles

  摘要：

  A rapid, improved, and environmentally benign synthesis of 5-substituted 2-amino-1,3,4-oxadiazoles by one-pot electrocyclization of acylthiosemicarbazones is reported. Controlled potential electrolysis was performed at room temperature in acetonitrile as non-aqueous solvent and LiClO4 as supporting electrolyte. The reaction products were characterized by spectroscopic methods and a mechanism was deduced from voltammetric data. Better yields at room temperature, shortest reaction time, and easy work-up are attractive features of this green procedure.

  DOI：

  10.1007/s00706-011-0711-3
• 作为产物：
  描述：

  2-萘氧乙酸 在 硫酸 、 一水合肼 作用下， 以 乙醇 为溶剂， 反应 21.0h， 生成 1-(3-Chlorophenyl)-3-[(2-naphthalen-2-yloxyacetyl)amino]thiourea
  参考文献：
  名称：

  Shahar Yar; Ahmad Siddiqui; Ashraf Ali, Journal of the Chinese Chemical Society, 2007, vol. 54, # 1, p. 5 - 8

  摘要：

  DOI：

文献信息

• Shahar Yar; Ahmad Siddiqui; Ashraf Ali, Journal of the Chinese Chemical Society, 2007, vol. 54, # 1, p. 5 - 8
  作者：Shahar Yar、Ahmad Siddiqui、Ashraf Ali

  DOI：——

  日期：——
• Electrochemically initiated oxidative cyclization: a versatile route for the synthesis of 5-substituted 2-amino-1,3,4-oxadiazoles
  作者：Sushma Singh、Laxmi Kant Sharma、Apoorv Saraswat、R. K. P. Singh

  DOI：10.1007/s00706-011-0711-3

  日期：2012.10

  A rapid, improved, and environmentally benign synthesis of 5-substituted 2-amino-1,3,4-oxadiazoles by one-pot electrocyclization of acylthiosemicarbazones is reported. Controlled potential electrolysis was performed at room temperature in acetonitrile as non-aqueous solvent and LiClO4 as supporting electrolyte. The reaction products were characterized by spectroscopic methods and a mechanism was deduced from voltammetric data. Better yields at room temperature, shortest reaction time, and easy work-up are attractive features of this green procedure.