4-((1R,2S,6R,7S)-3,5-Dioxo-4-aza-tricyclo[5.2.1.0^2,6]dec-8-en-4-yl)-benzoic acid

• 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: 4-((1R,2S,6R,7S)-3,5-Dioxo-4-aza-tricyclo[5.2.1.0^2,6]dec-8-en-4-yl)-benzoic acid
• 英文别名: 4-[(1R,2S,6R,7S)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]benzoic acid
• 化学式: C₁₆H₁₃NO₄
• 分子量: 283.284
• InChiKey: NIGPPPVPMJYXFY-NIFPGPBJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  21
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  74.7
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  4-((1R,2S,6R,7S)-3,5-Dioxo-4-aza-tricyclo[5.2.1.0^2,6]dec-8-en-4-yl)-benzoic acid 在 硫酸 、 双氧水 作用下， 反应 2.0h， 生成 2-exo-hydroxy-5-oxo-4-oxatricyclo[4.2.1.0^3,7]nonane-9-carboxylic acid
  参考文献：
  名称：

  摘要：

  Epoxidation of endo- and evo-bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid N-arylimides with a solution of peracetic acid in anhydrous dioxane affords 5,6-exo-epoxybicycloheptanedicarboxylic acid N-arylimides. The epoxidation reaction is not sensitive to the configuration of the imide fragment, to the character and position of the substituent in the aromatic ring. The reaction is determined only by oxidation conditions.

  DOI：

  10.1023/a:1015573902465
• 作为产物：
  描述：

  对氨基苯甲酸 、 3,6-endomethylene-1,2,3,6-tetrahydrophthalic anhydride 在 4-二甲氨基吡啶 、 溶剂黄146 作用下， 反应 24.0h， 以78.2%的产率得到4-((1R,2S,6R,7S)-3,5-Dioxo-4-aza-tricyclo[5.2.1.0^2,6]dec-8-en-4-yl)-benzoic acid
  参考文献：
  名称：

  含偶氮苯侧链离子复分解聚合物：简便合成、自组装和光响应行为

  摘要：

  一系列定义明确的偶氮苯官能化离聚物是通过降冰片烯-二甲酰亚胺的开环复分解聚合反应制备的，该离子基团与离子液体中的偶氮苯单元进一步连接。相应的含偶氮苯非离子聚合物也采用类似方法合成。基于分子量和进料比之间的线性关系，所有聚合被确认为活性特征。正如预期的那样，在紫外线和可见光交替照射下观察到离聚物中偶氮苯单元的独特光响应特性，这是传统的含偶氮苯非离子聚合物无法实现的。trans-cis的能力和效率由于偶氮苯单元附近存在离子基团，光异构化在一定程度上受到抑制。此外，这些离聚物的尺寸和形态可以通过改变亚甲基间隔物的数量来调节，以产生规则和均匀的球形纳米结构，最终导致独特的光异构化行为。所有这些有趣的结果不仅将为构建光敏离子复分解聚合物提供一种简便有效的方法，而且还将扩展含偶氮苯聚合物的光学性能和应用前景。

  DOI：

  10.1016/j.polymer.2021.124183

文献信息

• WNT INHIBITORS FOR HUMAN STEM CELL DIFFERENTIATION
  申请人：Cashman John

  公开号：US20130177535A1

  公开（公告）日：2013-07-11

  Methods and small molecule compounds for stem cell differentiation and treatment of animals with diseases are provided. One example of a class of compounds that may be used is represented by the compound of Formula I and II: or a pharmaceutically acceptable salt or solvate thereof, wherein A, X, Q, R 1 , R 2 , R 3 , R 4 are as described herein.

  提供了用于干细胞分化和治疗患有疾病的动物的方法和小分子化合物。可以使用的一类化合物的一个示例由式I和II表示： 或其药用可接受的盐或溶剂，其中A、X、Q、R1、R2、R3、R4如本文所述。
• Stereochemistry of dihydroxylation of N-arylbicyclo[2.2.1]-hept-5-ene-endo- and -exo-2,3-dicarboximides
  作者：B. T. Bagmanov

  DOI：10.1134/s1070428007110097

  日期：2007.11

  Stereochemistry of the oxidation of N-arylbicyclo[2.2.1]hept-5-ene-endo-and-exo-2,3-dicarboximides at the double bond with peroxyacetic acid generated in situ in the presence of sulfuric acid and with an anhydrous dioxane solution of peroxyacetic acid was studied. In both cases, the reaction was stereospecific, regardless of the substituent in the N-aryl group and configuration of the imide ring, but the reaction direction depended on the presence of water in the system. In the first case, the corresponding trans-5,6-dihydroxy derivatives were formed, while in the second, exo-5,6-epoxy derivatives. The oxidation of N-arylbicyclo[2.2.1]-hept-5-ene-endo-and-exo-2,3-dicarboximides with a solution of potassium permanganate in aqueous acetone gave the corresponding N-aryl-cis-5,6-dihydroxybicyclo[2.2.1]heptane-endo-and-exo-2,3-dicarboximides. The exo,cis,exo and exo,cis,endo configurations of the synthesized compounds were determined by H-1 NMR spectroscopy.
• Spatial arrangement of norbornanedicarboxylic acids N-arylimides
  作者：M. S. Salakhov、B. T. Bagmanov、N. S. Nabiev

  DOI：10.1134/s1070428010110023

  日期：2010.11

  The effect of substituents on the spatial arrangement of norbornane compounds was investigated. Norbornanedicarboxylic acids N-arylimides with OCH(3), Cl, NO(2) groups in the ortho-position of the aromatic ring form as conformational isomers with hindered rotation. The specific spatial isomerism is confirmed by the quantum-chemical calculations.
• SALAXOV M. S.; BAGMANOV B. T.; NAGIEV V. A., IN-T XLORORGAN. SINTEZA AN AZSSR, SUMGAIT,(1986) 12 S., IL., VINITI , 862+
  作者：SALAXOV M. S.、 BAGMANOV B. T.、 NAGIEV V. A.

  DOI：——

  日期：——
• US9023340B2
  申请人：——

  公开号：US9023340B2

  公开（公告）日：2015-05-05