6-Butylsulfanyl-2-(2-dimethylamino-ethyl)-benzo[de]isoquinoline-1,3-dione | 1070305-19-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异喹啉及其衍生物
• 英文名称: 6-Butylsulfanyl-2-(2-dimethylamino-ethyl)-benzo[de]isoquinoline-1,3-dione
• 英文别名: 6-Butylsulfanyl-2-[2-(dimethylamino)ethyl]benzo[de]isoquinoline-1,3-dione
• CAS: 1070305-19-9
• 化学式: C₂₀H₂₄N₂O₂S
• 分子量: 356.489
• InChiKey: JJDYQYSPOPMSEO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  25
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  65.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  4-butylthio-1,8-naphthalic anhydride 、 N,N-二甲基乙二胺 以 乙醇 为溶剂， 反应 6.5h， 以56%的产率得到6-Butylsulfanyl-2-(2-dimethylamino-ethyl)-benzo[de]isoquinoline-1,3-dione
  参考文献：
  名称：

  Sulfur-substituted naphthalimides as photoactivatable anticancer agents: DNA interaction, fluorescence imaging, and phototoxic effects in cultured tumor cells

  摘要：

  A series of sulfur-substituted naphthalimides (1-5) was prepared and investigated as antitumor drugs. Initial DNA interaction studies (by the fluorescence quenching method, UV/vis and CD spectroscopy, thermal denaturation, topoisomerase Western blot analysis, and DNA photocleavage experiments) expectedly suggested the DNA and topoisomerase as main targets of the agents. Fluorescence spectroscopic and microscopic experiments indicated a significant sensitivity of the emission intensities of 3 and 5 to the cellular environment and confirmed the cellular uptake and biodistribution into cell compartments for 1-3 and 5. A comparative evaluation of the antiproliferative effects under different experimental setups (concerning drug exposure period and an additional short-time UV irradiation) revealed significant phototoxic effects for the environmentally sensitive compounds 3 and 5 and strongly suggested the further development of sulfur-substituted naphthalimides for potential use in photodynamic tumor therapy. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2008.06.052

文献信息

• Method for identifying electrophiles and nucleophiles in a sample
  申请人：Eichen Yoav

  公开号：US20090258430A1

  公开（公告）日：2009-10-15

  A method and device for identifying a molecule in a sample, the molecule comprising an electrophilic or nucleophilic moiety. The method comprises contacting the sample with a plurality of chemosensors, each of the chemosensors comprising a π-conjugated system and a moiety having a nucleophilic property or an electrophilic property; and measuring an electromagnetic property of each of the chemosensors in the sample; whereby the pattern of changes in the electromagnetic properties of the plurality of chemosensors after chemically reacting with the electrophile or nucleophile of the molecule identifies the molecule in said sample. The device comprises a substrate carrying a plurality of chemosensor molecules having at least one predetermined electromagnetic property, the at least one electromagnetic property being changeable by subjecting the chemosensor molecules to a sample containing at least one electrophile or nuclephile, wherein the pattern of change of the electromagnetic property of the plurality of chemosensor molecules allows the device to identify the electrophile or nuclephile in the sample.

  一种用于识别样品中分子的方法和装置，该分子包括亲电或亲核基团。该方法包括将样品与多个化学传感器接触，每个化学传感器包括一个π-共轭系统和一个具有亲核性或亲电性的基团；并测量样品中每个化学传感器的电磁性质；因此，在化学反应与分子的亲电或亲核基团后，多个化学传感器的电磁性质的变化模式可以识别样品中的分子。该装置包括一个基板，携带多个化学传感器分子，具有至少一个预定的电磁性质，至少一个电磁性质可通过将化学传感器分子暴露于包含至少一个亲电或亲核物质的样品中而改变，多个化学传感器分子的电磁性质的变化模式允许该装置识别样品中的亲电或亲核物质。
• METHOD FOR IDENTIFYING ELECTROPHILES AND NUCLEOPHILES IN A SAMPLE
  申请人：Eichen Yoav

  公开号：US20110281742A1

  公开（公告）日：2011-11-17

  A method and device for identifying a molecule in a sample, the molecule comprising an electrophilic or nucleophilic moiety. The method comprises contacting the sample with a plurality of chemosensors, each of the chemosensors comprising a π-conjugated system and a moiety having a nucleophilic property or an electrophilic property; and measuring an electromagnetic property of each of the chemosensors in the sample; whereby the pattern of changes in the electromagnetic properties of the plurality of chemosensors after chemically reacting with the electrophile or nucleophile of the molecule identifies the molecule in said sample. The device comprises a substrate carrying a plurality of chemosensor molecules having at least one predetermined electromagnetic property, the at least one electromagnetic property being changeable by subjecting the chemosensor molecules to a sample containing at least one electrophile or nuclephile, wherein the pattern of change of the electromagnetic property of the plurality of chemosensor molecules allows the device to identify the electrophile or nuclephile in the sample.

  一种用于鉴定样品中分子的方法和装置，其中该分子包含一个亲电或亲核基团。该方法包括将样品与多个化学传感器接触，每个化学传感器包括一个π共轭系统和一个具有亲核性或亲电性的基团；并测量样品中每个化学传感器的电磁性质；因此，在化学反应后，多个化学传感器的电磁性质变化的模式可以鉴定样品中的分子。该装置包括一个基质，携带有多个化学传感器分子，其中至少有一个预定的电磁性质，通过将化学传感器分子置于至少含有一个亲电或亲核物的样品中，可以改变至少一个电磁性质，多个化学传感器分子的电磁性质变化模式允许该装置鉴定样品中的亲电或亲核物。
• US9518964B2
  申请人：——

  公开号：US9518964B2

  公开（公告）日：2016-12-13