N-(2,3-dimethylphenyl)-2-(morpholin-4-yl)-2-thioxoacetamide | 717139-54-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: N-(2,3-dimethylphenyl)-2-(morpholin-4-yl)-2-thioxoacetamide
• 英文别名: N-(2,3-dimethylphenyl)-2-morpholin-4-yl-2-sulfanylideneacetamide
• CAS: 717139-54-3
• 化学式: C₁₄H₁₈N₂O₂S
• 分子量: 278.375
• InChiKey: ANIKPAFDZQCYRV-UHFFFAOYSA-N

物化性质

• 密度：
  1.258±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  19
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  73.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  N-(2,3-dimethylphenyl)-2-(morpholin-4-yl)-2-thioxoacetamide 在 一水合肼 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以68%的产率得到N(1)-(2,3-dimethylphenyl)-2-hydrazino-2-thioxoacetamide
  参考文献：
  名称：

  Synthesis of Oxamic Acids Thiohydrazides and Carbamoyl-1,3,4-thiadiazoles

  摘要：

  A convenient preparation method was developed for oxamic acids thiohydrazides by reaction of alpha-chloroacetamides with a preliminary prepared solution of elemental sulfur and hydrazines. A series of carbamoyl-1,3,4-thiadiazole derivatives was obtained.

  DOI：

  10.1023/b:rujo.0000010181.01921.77
• 作为产物：
  描述：

  吗啉 、 2-氯-N-(2,3-二甲基苯基)-乙酰胺 在 sulfur 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 1.0h， 生成 N-(2,3-dimethylphenyl)-2-(morpholin-4-yl)-2-thioxoacetamide
  参考文献：
  名称：

  Synthesis of Oxamic Acids Thiohydrazides and Carbamoyl-1,3,4-thiadiazoles

  摘要：

  A convenient preparation method was developed for oxamic acids thiohydrazides by reaction of alpha-chloroacetamides with a preliminary prepared solution of elemental sulfur and hydrazines. A series of carbamoyl-1,3,4-thiadiazole derivatives was obtained.

  DOI：

  10.1023/b:rujo.0000010181.01921.77

文献信息

• Reactions of monothiooxamides with O-methylhydroxylamine
  作者：I. V. Zavarzin、V. N. Yarovenko、E. I. Chernoburova、M. A. Shchetinina、M. M. Krayushkin

  DOI：10.1023/b:rucb.0000030829.75754.a2

  日期：2004.2

  The reactions of monothiooxamides with O-methylhydroxylamine were studied. Depending on the substituents in monothiooxamides, the reactions result in the formation of hydroxamic C acid derivatives or various N-methoxy derivatives of amidoximes.
• Synthesis of Oxamic Acids Thiohydrazides and Carbamoyl-1,3,4-thiadiazoles
  作者：V. N. Yarovenko、A. V. Shirokov、O. N. Krupinova、I. V. Zavarzin、M. M. Krayushkin

  DOI：10.1023/b:rujo.0000010181.01921.77

  日期：2003.8

  A convenient preparation method was developed for oxamic acids thiohydrazides by reaction of alpha-chloroacetamides with a preliminary prepared solution of elemental sulfur and hydrazines. A series of carbamoyl-1,3,4-thiadiazole derivatives was obtained.