N-甲基-N-(2-噻吩基)硫代乙酰胺 | 172896-61-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 杂芳族化合物
• 中文名称: N-甲基-N-(2-噻吩基)硫代乙酰胺
• 英文名称: N-methyl-N-(2-thienyl)thioacetamide
• 英文别名: N-methyl-N-thiophen-2-ylethanethioamide
• CAS: 172896-61-6
• 化学式: C₇H₉NS₂
• 分子量: 171.287
• InChiKey: LSHALEHGMDBMGL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  10
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  63.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  二氧化碳 、 N-甲基-N-(2-噻吩基)硫代乙酰胺 在 正丁基锂 、 二异丙胺 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 以38%的产率得到N-methyl-N-(2-thienyl)thiocarbamoylacetic acid
  参考文献：
  名称：

  The First Synthesis of N-Alkyl-N-Arylthiocarbamoylacetates and Acetic Acids

  摘要：

  N-Alkyl-N-arylthiocarbamoylacetates, the key intermediates for the synthesis of novel antinephritic agents, have been prepared for the first time. Some of the esters were in turn hydrolyzed to the corresponding acids, An alternative, indirect synthetic route was also developed to prepare some unusual acids.

  DOI：

  10.1080/00397910008087354
• 作为产物：
  描述：

  N-methyl-N-(2-thienyl)-acetamide 在 tetraphosphorus decasulfide 作用下， 以 甲苯 为溶剂， 反应 1.0h， 以72%的产率得到N-甲基-N-(2-噻吩基)硫代乙酰胺
  参考文献：
  名称：

  The First Synthesis of N-Alkyl-N-Arylthiocarbamoylacetates and Acetic Acids

  摘要：

  N-Alkyl-N-arylthiocarbamoylacetates, the key intermediates for the synthesis of novel antinephritic agents, have been prepared for the first time. Some of the esters were in turn hydrolyzed to the corresponding acids, An alternative, indirect synthetic route was also developed to prepare some unusual acids.

  DOI：

  10.1080/00397910008087354

文献信息

• The First Synthesis of N-Alkyl-N-Arylthiocarbamoylacetates and Acetic Acids
  作者：Glen W. Spears、Kiyoshi Tsuji、Takashi Tojo、Hiroaki Nishimura、Takashi Ogino

  DOI：10.1080/00397910008087354

  日期：2000.2

  N-Alkyl-N-arylthiocarbamoylacetates, the key intermediates for the synthesis of novel antinephritic agents, have been prepared for the first time. Some of the esters were in turn hydrolyzed to the corresponding acids, An alternative, indirect synthetic route was also developed to prepare some unusual acids.