N-(2-aminoethyl)-4-[2,2-bis[3-(2-methoxyethoxy)prop-1-ynyl]-4,6,10,12-tetramethyl-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-8-yl]benzamide | 1232501-91-5

• 英文名称: N-(2-aminoethyl)-4-[2,2-bis[3-(2-methoxyethoxy)prop-1-ynyl]-4,6,10,12-tetramethyl-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-8-yl]benzamide
• CAS: 1232501-91-5
• 化学式: C₃₄H₄₃BN₄O₅
• 分子量: 598.55
• InChiKey: CRTYUZPVOTWJGQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  44
• 可旋转键数：
  14
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  100
• 氢给体数：
  2
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  4-[10-[4-[3,5-Bis[[3,5-bis[10-[4-[4-(4-cyanophenyl)phenoxy]carbonylphenoxy]decoxycarbonyl]phenoxy]carbonyl]phenoxy]carbonylphenoxy]decoxycarbonyl]benzoic acid 、 N-(2-aminoethyl)-4-[2,2-bis[3-(2-methoxyethoxy)prop-1-ynyl]-4,6,10,12-tetramethyl-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-8-yl]benzamide 在 4-二甲氨基吡啶 、 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 反应 48.0h， 以78%的产率得到
  参考文献：
  名称：

  Red and Blue Liquid-Crystalline Borondipyrromethene Dendrimers

  摘要：

  We have designed a series of modular arid fluorescent poly(arylester) dendrimers fimetionalized with cyanobiphenyl subunits and fluorescent borondipyrromethene (Bodipy) dyes. The green emitter is a Bodipy With four Methyl groups, and the Bodipy dye possessing extended conjugation with two methyl and two vinyl, groups acts as a red emitter. The design elerrient of these architectures relates to a secondary amide linkers interposed between the conventional Bodipy and the dendrons. The second- and thirdgeneration dendrimers give rise to ternatic and/or srneetic A phases, whereas the first generation clendrimers show smeCtie A and C phases or an unidentified meSophase. The novel materials are highly fluorescent in solution and in the as obtained powders but not in the ineSophaSe. Dilution of the dendritic dyes with the nonfluorekent acid dendron in the solid phase shifted the fluorescence to higher energy, and demonstrated the presence of aggregates in the solid state, Mixing the red and blue Materials in a solid, phase led to the observation of effective electronic energy transfer from the red dye to the blue one. Increasing the proportion of the red dye (energy donor) from 1 to 2,50 molar with respect to the blue dye (euergy acceptor) resulted in the observation of residual emission of the red dye in the solid state mixture. Increasing the proportion from 1 to 1000 resulted in equal emission in the 540 to 760 nm range.

  DOI：

  10.1021/cm503577y
• 作为产物：
  描述：

  3-(2-methoxyethoxy)prop-1-yne 在 bis-triphenylphosphine-palladium(II) chloride 、 乙基溴化镁 、 三乙胺 作用下， 以 四氢呋喃 、 苯 为溶剂， 反应 2.0h， 生成 N-(2-aminoethyl)-4-[2,2-bis[3-(2-methoxyethoxy)prop-1-ynyl]-4,6,10,12-tetramethyl-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-8-yl]benzamide
  参考文献：
  名称：

  Carbonyl Derivatives of Boradiazaindacene via Catalytic CO Insertion

  摘要：

  A methodological study is presented dealing with carbopalladation reactions on BODIPY dyes bearing aryl halogen functions. Using this technique, several ester and amide groups were efficiently introduced on the dyes. These changes do not affect the optical properties of the dyes and thus allow the construction of new BODIPY-based functional dyes with carboxylic anchoring groups or peptide links.

  DOI：

  10.1021/jo300477p

文献信息

• Fluorescent boron-substituted dipyrromethenes and use thereof for diagnosis
  申请人：De Barry Jean

  公开号：US08993781B2

  公开（公告）日：2015-03-31

  The invention relates to novel fluorescent compounds derived from non-fluorinated dipyrromethene-boron, to a method for preparing same and to the use thereof for the fluorescent marking of biological molecules. The invention also relates to biological molecules marked with said fluorescent compounds, and to the use thereof in detection methods such as medical diagnosis methods. More particularly, the detection methods of the invention are particularly useful for diagnosing neurodegenerative diseases such as Alzheimer's disease.

  该发明涉及从非氟化二吡咯甲烷硼衍生的新型荧光化合物，以及制备该化合物的方法和将其用于生物分子的荧光标记。该发明还涉及用所述荧光化合物标记的生物分子，以及将其用于诊断方法如医学诊断方法。更具体地说，该发明的检测方法特别适用于诊断诸如阿尔茨海默病等神经退行性疾病。