[2-((anthracen-9-ylmethyl)amino)ethyl]carbamic acid tert-butyl ester | 1172602-84-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: [2-((anthracen-9-ylmethyl)amino)ethyl]carbamic acid tert-butyl ester
• 英文别名: tert-butyl N-[2-(anthracen-9-ylmethylamino)ethyl]carbamate
• CAS: 1172602-84-4
• 化学式: C₂₂H₂₆N₂O₂
• 分子量: 350.461
• InChiKey: WJDBIIOUCASUIQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.61
• 重原子数：
  26.0
• 可旋转键数：
  5.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  50.36
• 氢给体数：
  2.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  [2-((anthracen-9-ylmethyl)amino)ethyl]carbamic acid tert-butyl ester 在 哌啶 、 三乙胺 、 N,N-二异丙基乙胺 、 Methanaminium,N-[(dimethylamino)(3H-1,2,3-triazolo[4,5-b]pyridin-3-yloxy)methylene]-N-methyl-, hexafluorophosphate(1-) 、 三氟乙酸 作用下， 以 四氢呋喃 、 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 38.0h， 生成 [2-[[[2-[(2S,4S)-4-amino-2-[2-[anthracen-9-ylmethyl-[(2-boronophenyl)methyl]amino]ethylcarbamoyl]pyrrolidin-1-yl]-2-oxoethyl]-[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]methyl]phenyl]boronic acid
  参考文献：
  名称：

  组合荧光分子传感器进行药物检测

  摘要：

  共同探索真相：分子大小的诊断系统，结合了多个识别元件和四个荧光发射通道，能够根据不同的光物理过程识别多种药物。分子传感器（参见简化表示； ID =标识）还用于以高通量方式分析尿液样品中的药物浓度和组合。

  DOI：

  10.1002/anie.201206374
• 作为产物：
  描述：

  9-蒽甲醛 在 sodium tetrahydroborate 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 生成 [2-((anthracen-9-ylmethyl)amino)ethyl]carbamic acid tert-butyl ester
  参考文献：
  名称：

  MOTUPORAMINE DERIVATIVES AS ANTIMICROBIAL AGENTS AND ANTIBIOTIC ENHANCERS AGAINST RESISTANT GRAM-NEGATIVE BACTERIA

  摘要：

  Motuporamine代理具有抗微生物活性及其用途。

  公开号：

  US20180258029A1

文献信息

• [EN] MULTI-SENSOR ARRAY COMPOUND AND METHODS OF USE THEREOF<br/>[FR] COMPOSÉ DE RÉSEAU MULTICAPTEUR ET SES PROCÉDÉS D'UTILISATION
  申请人：YEDA RES & DEV

  公开号：WO2014013485A1

  公开（公告）日：2014-01-23

  The present invention is directed to a multi-sensor array compound including at least three chromophores, at least one receptor and an anchor. Contacting the compound of this invention with an analyte (such as carbohydrate) forms a complex with unique optical signature. The unique optical signature allows differentiating between carbohydrates, diagnosing diseases associated with the carbohydrate, and encoding information in an encoding system.

  本发明涉及一种多传感器阵列化合物，包括至少三种色素、至少一种受体和一个锚。将本发明的化合物与分析物（如碳水化合物）接触形成具有独特光学特征的复合物。这种独特的光学特征可以区分碳水化合物，诊断与碳水化合物相关的疾病，并在编码系统中编码信息。
• Synthesis, DNA binding and photocleavage study of novel anthracene-appended macrocyclic polyamines
  作者：Yu Huang、Yu Zhang、Ji Zhang、Da-Wei Zhang、Qiao-Sen Lu、Jun-Liang Liu、Shan-Yong Chen、Hong-Hui Lin、Xiao-Qi Yu

  DOI：10.1039/b823416g

  日期：——

  Through the fluorescence titration data, compound 1 shows distinct CG-selective DNA binding activity. DNA melting and viscometric titration experiments indicate that the binding mode of 2 is a multiple binding mode that involves groove binding and partial intercalation. Compound 2 also shows excellent DNA photocleavage ability, which is much more efficient than the mono-anthryl compound 1.

  两个蒽衍生物附加在cyclen（1,4,7,10-四氮杂环十二烷）部分被合成和表征。在这些新化合物中，蒽基被用作经典PNA骨架的核碱基的替代物，而cycln部分则附加在末端氨基上。通过吸收，荧光和粘度滴定，DNA熔解和凝胶电泳实验系统地研究了化合物与DNA的相互作用。根据吸收滴定数据，双蒽化合物2可以与CT DNA结合ķ b= 1.21×10 5 M -1，比其大121倍单蒽基化合物1（ķ b= 1.00×10 3 M -1）。通过荧光滴定数据，化合物1显示出独特的CG选择性DNA结合活性。DNA熔解和粘度滴定实验表明2的结合模式是涉及凹槽结合和部分嵌入的多重结合模式。化合物2还显示出出色的DNA光裂解能力，这比单蒽化合物1更有效。
• Multi-sensor array compound and methods of use thereof
  申请人：YEDA RESEARCH AND DEVELOPMENT CO.LTD.

  公开号：US10017525B2

  公开（公告）日：2018-07-10

  The present invention is directed to a multi-sensor array compound including at least three chromophores, at least one receptor and an anchor. Contacting the compound of this invention with an analyte (such as carbohydrate) forms a complex with unique optical signature. The unique optical signature allows differentiating between carbohydrates, diagnosing diseases associated with the carbohydrate, and encoding information in an encoding system.

  本发明涉及一种多传感器阵列化合物，包括至少三个发色团、至少一个受体和一个锚。本发明的化合物与分析物（如碳水化合物）接触后会形成具有独特光学特征的复合物。这种独特的光学特征可用于区分碳水化合物、诊断与碳水化合物相关的疾病以及在编码系统中编码信息。
• Motuporamine derivatives as antimicrobial agents and antibiotic enhancers against resistant gram-negative bacteria
  申请人：University of Central Florida Research Foundation, Inc.

  公开号：US10710957B2

  公开（公告）日：2020-07-14

  Motuporamine agents having antimicrobial activity and uses thereof.

  具有抗菌活性的莫土伯胺制剂及其用途。
• Synthesis and Bioevaluation of Macrocycle–Polyamine Conjugates as Cell Migration Inhibitors
  作者：Kristen Skruber、Kelvin J. Chaplin、Otto Phanstiel

  DOI：10.1021/acs.jmedchem.7b01222

  日期：2017.10.26

  The motuporamines are natural products isolated from the New Guinea sea sponge Xestospongia exigua. Dihydromotuporamine C contains a large macrocycle and an appended polyamine component and was shown to be both antimetastatic and cytotoxic to human L3.6pl pancreatic cancer cells. A series of macrocycle?polyamine conjugates were prepared, and the sequence of the polyamine component was varied to optimize the antimigration properties (as measured in L3.6pl cells) of this molecular class. A one-carbon spacer between the 15-membered carbocycle and the appended polyamine showed improved antimigration properties. A survey of different polyamine sequences containing two, three, or four carbon spacers revealed that the natural polyamine sequence (norspermidine, a 3,3-triamine) was superior in terms of inhibiting the migration of L3.6pl cells in vitro. An investigation of the respective ceramide and sphingomyelin populations in L3.6pl cells revealed that these molecules can modulate both ceramide and sphingomyelin pools in cells and inhibit cell migration.