methyl 2-amino-3,6-dimethoxybenzoate | 208986-13-4

• 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: methyl 2-amino-3,6-dimethoxybenzoate
• CAS: 208986-13-4
• 化学式: C₁₀H₁₃NO₄
• 分子量: 211.218
• InChiKey: OTHQPKHYNGELRX-UHFFFAOYSA-N

物化性质

• 沸点：
  344.1±37.0 °C(Predicted)
• 密度：
  1.189±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  70.8
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  methyl 2-amino-3,6-dimethoxybenzoate 在 三氯氧磷 作用下， 以 四氢呋喃 为溶剂， 生成 4-氯-5,8-二甲氧基喹啉-3-甲腈
  参考文献：
  名称：

  Synthesis and Structure–Activity Relationships of 3-Cyano-4-(phenoxyanilino)quinolines as MEK (MAPKK) Inhibitors

  摘要：

  A series of 3-cyano-4-(phenoxyanilino)cyanoquinolines has been prepared as MEK (MAP kinase kinase) inhibitors. The best activity is seen with alkoxy groups at both the 6- and 7-positions. The lead compounds show low nanomolar IC50's against MAP kinase kinase, and have potent inhibitory activity in tumor cells. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00580-1
• 作为产物：
  描述：

  4,7-dimethoxyindoline-2,3-dione 在 sodium tetrahydroborate 作用下， 以 甲醇 为溶剂， 反应 36.0h， 以70%的产率得到methyl 2-amino-3,6-dimethoxybenzoate
  参考文献：
  名称：

  3-乙基氧吲哚-4,7-醌的制备†

  摘要：

  3- ethyloxindole -4,7-苯醌的制备10从4,7- dimethoxyisatin 1在四个步骤进行说明。

  DOI：

  10.1039/a707530h

文献信息

• Synthesis of (±)-Puraquinonic Acid:  An Inducer of Cell Differentiation
  作者：Derrick L. J. Clive、Mousumi Sannigrahi、Soleiman Hisaindee

  DOI：10.1021/jo001523s

  日期：2001.2.1

  Puraquinonic acid (1) was synthesized from 2,5-dimethoxybenzoic acid by way of isochroman 2 and the indanone derivative 3, a Nazarov cyclization being used to construct the five-membered ring.
• Synthesis and Structure–Activity Relationships of 3-Cyano-4-(phenoxyanilino)quinolines as MEK (MAPKK) Inhibitors
  作者：Nan Zhang、Biqi Wu、Dennis Powell、Allan Wissner、Middleton B. Floyd、Eleonora D. Kovacs、Lourdes Toral-Barza、Constance Kohler

  DOI：10.1016/s0960-894x(00)00580-1

  日期：2000.12

  A series of 3-cyano-4-(phenoxyanilino)cyanoquinolines has been prepared as MEK (MAP kinase kinase) inhibitors. The best activity is seen with alkoxy groups at both the 6- and 7-positions. The lead compounds show low nanomolar IC50's against MAP kinase kinase, and have potent inhibitory activity in tumor cells. (C) 2000 Elsevier Science Ltd. All rights reserved.
• Preparation of 3-Ethyloxindole-4,7-quinone†
  作者：Lina K. Mehta、John Parrick、Fereshteh Payne

  DOI：10.1039/a707530h

  日期：——

  The preparation of 3-ethyloxindole-4,7-quinone 10 from 4,7-dimethoxyisatin 1 in four steps is described.

  3- ethyloxindole -4,7-苯醌的制备10从4,7- dimethoxyisatin 1在四个步骤进行说明。