3-Phenyl-5-(3,4,5-trimethoxyphenyl)isoxazole

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 3-Phenyl-5-(3,4,5-trimethoxyphenyl)isoxazole
• 英文别名: 3-Phenyl-5-(3,4,5-trimethoxyphenyl)-1,2-oxazole；3-phenyl-5-(3,4,5-trimethoxyphenyl)-1,2-oxazole
• 化学式: C₁₈H₁₇NO₄
• 分子量: 311.337
• InChiKey: JMPOAZXETSFVLX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  23
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  53.7
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  3.4.5-三甲氧基苯乙炔 、 苯甲醛肟 在 sodium hypochlorite 、 三乙胺 作用下， 以 二氯甲烷 、 水 为溶剂， 反应 24.0h， 以58%的产率得到3-Phenyl-5-(3,4,5-trimethoxyphenyl)isoxazole
  参考文献：
  名称：

  1,3-Dipolar cycloaddition route to novel isoxazole-type derivatives related to combretastatin A-4

  摘要：

  A series of compounds related to combretastatin A-4, containing a five-membered heterocyclic ring interposed between the two phenyl groups have been Prepared. Synthetic approach involves 1,3-dipolar cycloaddition of various 3,4,5-trimethoxyphenyl units with an in situ generated nitrile oxide from a suitable aldoxime using sodium hypochlorite. Depending oil the nature of the dipolarophile, 3,5-diarylisoxazole derivatives obtained along with the 3,4-regioisomeric isomers. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2004.03.020

文献信息

• ISOXAZOLE/ISOXAZOLINE/COMBRETASTATIN LINKED DIHYDROQUINAZOLINONE HYBRIDS AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF
  申请人：Kamal Ahmed

  公开号：US20120283439A1

  公开（公告）日：2012-11-08

  The present invention provides a compound of general formulae 3a-i to 6a-i, 7a-i to 10a-i, 12a-i to 15a-i, 16a-i to 19a-i, 21a-i to 24a-i, 25a-i to 28a-i, 30a-i to 33a-i, 34a-i to 37a-i and 39a-i to 42a-i, 43a-i to 46a-i useful as potential antitumour agents against human cancer cell lines and a process for the preparation thereof.

  本发明提供了通式3a-i至6a-i、7a-i至10a-i、12a-i至15a-i、16a-i至19a-i、21a-i至24a-i、25a-i至28a-i、30a-i至33a-i、34a-i至37a-i和39a-i至42a-i、43a-i至46a-i的化合物，它们可用作潜在的抗人类癌细胞系肿瘤药物，并提供了其制备方法。
• US8883809B2
  申请人：——

  公开号：US8883809B2

  公开（公告）日：2014-11-11
• 1,3-Dipolar cycloaddition route to novel isoxazole-type derivatives related to combretastatin A-4
  作者：Julia Kaffy、Claude Monneret、Patrick Mailliet、Alain Commerçon、Renée Pontikis

  DOI：10.1016/j.tetlet.2004.03.020

  日期：2004.4

  A series of compounds related to combretastatin A-4, containing a five-membered heterocyclic ring interposed between the two phenyl groups have been Prepared. Synthetic approach involves 1,3-dipolar cycloaddition of various 3,4,5-trimethoxyphenyl units with an in situ generated nitrile oxide from a suitable aldoxime using sodium hypochlorite. Depending oil the nature of the dipolarophile, 3,5-diarylisoxazole derivatives obtained along with the 3,4-regioisomeric isomers. (C) 2004 Elsevier Ltd. All rights reserved.