3,5-bis[(bis(2-pyridylmethyl)amino)methyl]-benzoic acid | 791644-35-4

• 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: 3,5-bis[(bis(2-pyridylmethyl)amino)methyl]-benzoic acid
• 英文别名: 3,5-Bis[[bis(2-pyridylmethyl)amino]methyl]benzoic acid；3,5-bis[[bis(pyridin-2-ylmethyl)amino]methyl]benzoic acid
• CAS: 791644-35-4
• 化学式: C₃₃H₃₂N₆O₂
• 分子量: 544.656
• InChiKey: PJSLVCLEGMNPFJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  41
• 可旋转键数：
  13
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  95.3
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  methyl 3,5-bis[(bis(2-pyridylmethyl)amino)methyl]-benzoate 在 sodium hydroxide 作用下， 以 乙醇 为溶剂， 以7%的产率得到3,5-bis[(bis(2-pyridylmethyl)amino)methyl]-benzoic acid
  参考文献：
  名称：

  Polyglycerol-bound phosphotriesterase enzyme model complexes for detection and hydrolysis of phosphorus species in aqueous solution

  摘要：

  Phosphotriesterase models incorporating di(2-picolyl)amino ligands supported by m-xylylene or 2-hydroxy-m-xylylene scaffolds have been tethered to the periphery of a water-soluble hyperbranched polyglycerol (PG). In aqueous solution buffered at pH 7.4, the polymeric complexes of Zn2+ are useful receptors for polymeric indicator displacement assays for phosphate and pyrophosphate employing commercial complexometric indicators. Under the same conditions, the Co3+ effectively hydrolyze p-nitrophenylphosphate with approximately five orders of magnitude rate enhancement versus uncatalyzed hydrolysis. These systems offer promising results as mixed-metal dual detect-decontaminate materials for organophosphorus toxins under mild, neutral aqueous conditions. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.03.051

文献信息

• Compounds and Methods
  申请人：Baltzer Lars

  公开号：US20130261013A1

  公开（公告）日：2013-10-03

  A molecular tool for use in a method of providing a molecule that is capable of binding a target molecule based on a set of polypeptides. A polypeptide having a sequence selected from SEQ ID NOs 1-32. The polypeptide may be used in a method of screening for a ligand-polypeptide conjugate capable of binding a target molecule for the ligand. A ligand-polypeptide conjugate, useful e.g. in therapy.

  一种分子工具，可用于提供一种能够基于一组多肽结合目标分子的分子。其中一种多肽具有从SEQ ID NOs 1-32中选择的序列。该多肽可用于筛选配体-多肽共轭物，以便为配体结合目标分子。配体-多肽共轭物可用于治疗等方面。
• Compounds and methods
  申请人：Baltzer Lars

  公开号：US09377466B2

  公开（公告）日：2016-06-28

  A molecular tool for use in a method of providing a molecule that is capable of binding a target molecule based on a set of polypeptides. A polypeptide having a sequence selected from SEQ ID NOs 1-32. The polypeptide may be used in a method of screening for a ligand-polypeptide conjugate capable of binding a target molecule for the ligand. A ligand-polypeptide conjugate, useful e.g. in therapy.

  一种分子工具，用于提供一种分子，该分子能够基于一组多肽结合靶分子。其中一种多肽序列选择自SEQ ID NOs 1-32。该多肽可用于筛选能够结合靶分子的配体-多肽共轭物的方法。该配体-多肽共轭物可用于治疗等方面。
• COMPOUNDS AND METHODS
  申请人：Modpro AB

  公开号：EP2613796A2

  公开（公告）日：2013-07-17
• US9377466B2
  申请人：——

  公开号：US9377466B2

  公开（公告）日：2016-06-28
• [EN] COMPOUNDS AND METHODS<br/>[FR] COMPOSÉS ET PROCÉDÉS
  申请人：MODPRO AB

  公开号：WO2012032068A2

  公开（公告）日：2012-03-15

  A molecular tool for use in a method of providing a molecule that is capable of binding a target molecule based on a set of polypeptides. A polypeptide having a sequence selected from SEQ ID NOs 1-32. The polypeptide may be used in a method of screening for a ligand- polypeptide conjugate capable of binding a target molecule for the ligand. A ligand- polypeptide conjugate, useful e.g. in therapy.