N-tert-butyl-N-phenylacetamide | 91562-67-3

• 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-tert-butyl-N-phenylacetamide
• 英文别名: N-tert-butyl-acetanilide；N-tert-Butyl-acetanilid；N-tert-Butyl-acetanilid
• CAS: 91562-67-3
• 化学式: C₁₂H₁₇NO
• 分子量: 191.273
• InChiKey: UGBHGSVEQNCPOY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  20.3
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  N-tert-butyl-N-phenylacetamide 在 劳森试剂 、 正丁基锂 、 二异丙胺 作用下， 以 四氢呋喃 、 正己烷 、 苯 为溶剂， 反应 2.0h， 生成 N-tert-butyl-N-phenylthiocarbamoylacetic 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-叔丁基苯胺 、 乙酰氯 以 吡啶 、 二氯甲烷 为溶剂， 反应 0.17h， 以95%的产率得到N-tert-butyl-N-phenylacetamide
  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

• 222. The preparation of alkylanilines containing tertiary alkyl groups
  作者：W. J. Hickinbottom

  DOI：10.1039/jr9330000946

  日期：——
• OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS
  申请人：Pharmacia Italia S.p.A.

  公开号：EP1377589A1

  公开（公告）日：2004-01-07
• [EN] QUINOLINE DERIVATIVES AS IMMUNOMODULATORS<br/>[FR] DERIVES DE QUINOLINE UTILISES COMME IMMUNOMODULATEURS
  申请人：FUJISAWA PHARMACEUTICAL CO., LTD.

  公开号：WO1995024395A1

  公开（公告）日：1995-09-14

  (EN) Quinoline derivatives of formula (I), wherein R1 is hydrogen, halogen, lower alkyl, etc., R2 is hydroxy or protected hydroxy, R3 is lower alkyl, etc., (a) is a group of formula (i) (in which R4 is lower alkyl, lower alkenyl, lower alkoxy(lower)alkyl, cyclo(lower)alkyl or lower alkoxy(lower)alkoxy(lower)-alkyl, and R5 is aryl which may have suitable substitutent(s) or heterocyclic group), etc., R7 is hydrogen or halogen, R8 is hydrogen or lower alkyl, etc., and Z is O or S, and a pharmaceutically acceptable salt thereof which are useful as a medicament.(FR) L'invention concerne des dérivés de quinoline de formule (I) ainsi qu'un sel pharmaceutiquement acceptable de ces derniers, utilisés comme médicament. Dans ladite formule (I), R1 représente hydrogène, halogène, alkyle inférieur, etc., R2 représente hydroxy ou hydroxy protégé, R3 représente alkyle inférieur, etc., (a) est un groupe de formule (i) (dans laquelle R4 représente alkyle inférieur, alcényle inférieur, alcoxy inférieur-alkyle (inférieur), cyclo-alkyle (inférieur) ou alcoxy inférieur alcoxy-alkyle(inférieur), et R5 représente aryle ayant éventuellement un ou plusieurs substituant(s) ou un groupe hétérocycliques appropriés), etc., R7 représente hydrogène ou halogène, R8 représente hydrogène ou alkyle inférieur, etc., et Z correspond à O ou S.
• [EN] OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS<br/>[FR] DERIVES OXAZOLYL-PYRAZOLE INHIBITEURS DE KINASE
  申请人：PHARMACIA ITALIA SPA

  公开号：WO2002062804A1

  公开（公告）日：2002-08-15

  Compounds which are oxazolyl-pyrazole derivatives, as defined in the specification, and pharmaceutically acceptable salts thereof; are useful in the treatment of diseases caused by and/or associated with an altered protein kinase activity such as cancer, cell proliferative disorders, viral infections, autoimmune diseases and neurodegenerative disorders.
• 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.

表征谱图