biphenyl-2,2',4,4'-tetracarboxylic acid chloride

• 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: biphenyl-2,2',4,4'-tetracarboxylic acid chloride
• 英文别名: [1,1'-Biphenyl]-2,2',4,4'-tetracarbonyl tetrachloride；4-(2,4-dicarbonochloridoylphenyl)benzene-1,3-dicarbonyl chloride
• 化学式: C₁₆H₆Cl₄O₄
• 分子量: 404.033
• InChiKey: BOTACLWTAIRMFK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  24
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  68.3
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  4-溴-1,3-苯二甲酸二甲酯 在 sodium hydroxide 、 氯化亚砜 、 铜 、 N,N-二甲基甲酰胺 作用下， 以 四氢呋喃 、 甲醇 、 氯仿 为溶剂， 反应 12.0h， 生成 biphenyl-2,2',4,4'-tetracarboxylic acid chloride
  参考文献：
  名称：

  The activated core approach to combinatorial chemistry: A selection of new core molecules

  摘要：

  Four new activated core molecules suitable for use in solution-phase combinatorial organic chemistry have been prepared. These molecules represent an attempt to further explore shape-space and increase the structural diversity of prepared libraries, as well as to incorporate recognition elements in the cores to increase the chances for interaction with biological targets. Demonstrations of deconvolution strategies used to simplify complex libraries and build individual molecular species based on the cores are also provided. (C) 1998 Published by Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(98)00139-2

文献信息

• Method for identifying a member of a mass-coded combinatorial library
  申请人：Neogenesis, Inc.

  公开号：EP2241541A1

  公开（公告）日：2010-10-20

  The present invention relates to a method for identifying a member of a mass-coded molecular library which is a ligand for a biomolecule and binds to the biomolecule at the binding site of a known second ligand for the biomolecule, said mass-coded molecular library comprising compounds of the general formula XYn, wherein n is an. integer from 2 to about 6, X is a scaffold and each Y is, independently, a peripheral moiety, wherein said mass-coded molecular library is produced by reacting a scaffold precursor with a sufficient number of distinct peripheral moiety precursors such that there exist at least about 250 distinct combinations of n peripheral moieties derived from said peripheral moiety precursors.

  本发明涉及一种鉴定质量编码分子库成员的方法，所述质量编码分子库是生物大分子的配体，并在生物大分子的已知第二配体的结合位点与生物大分子结合，所述质量编码分子库包括通式XYn的化合物，其中n是2至约6的整数，X是支架，每个Y独立地是外围分子。2至约6的整数，X是支架，每个Y独立地是外周分子，其中所述质量编码分子库是通过将支架前体与足够数量的不同外周分子前体反应而产生的，从而存在至少约250种不同的由所述外周分子前体衍生的n个外周分子的组合。
• US7169563B2
  申请人：——

  公开号：US7169563B2

  公开（公告）日：2007-01-30
• US7269519B2
  申请人：——

  公开号：US7269519B2

  公开（公告）日：2007-09-11