蒽醌(苯并噻吩-2-羰基)肟 | 1033234-84-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 中文名称: 蒽醌(苯并噻吩-2-羰基)肟
• 英文名称: anthraquinone (benzothiophene-2-carbonyl)oxime
• 英文别名: [(10-Oxoanthracen-9-ylidene)amino] 1-benzothiophene-2-carboxylate
• CAS: 1033234-84-2
• 化学式: C₂₃H₁₃NO₃S
• 分子量: 383.427
• InChiKey: MOPNXWABTWSRLO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.2
• 重原子数：
  28
• 可旋转键数：
  3
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  84
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  苯并噻吩-2-羰酰氯 、 10-nitrosoanthracen-9-ol 在 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 反应 3.5h， 以73%的产率得到蒽醌(苯并噻吩-2-羰基)肟
  参考文献：
  名称：

  Photo-induced DNA cleavage by (heterocyclo)carbonyl oxime esters of anthraquinone

  摘要：

  Various (heterocyclo)carbonyl mono-oxime esters of anthraquinone were synthesized, which exhibited an ability for DNA cleavage upon UV irradiation. Their structure-activity relationship was established, in which the most potent compound was anthraquinone O-9-(1,3-benzothiazole-2-carbonyl)oxime (4j). It can produce radical species and nick DNA at the concentration as low as 1.0 mu M. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.03.056

文献信息

• Photo-induced DNA cleavage by (heterocyclo)carbonyl oxime esters of anthraquinone
  作者：Jih Ru Hwu、Jhih-Ren Yang、Shwu-Chen Tsay、Ming-Hua Hsu、Yi-Chieh Chen、Shang-Shing P. Chou

  DOI：10.1016/j.tetlet.2008.03.056

  日期：2008.5

  Various (heterocyclo)carbonyl mono-oxime esters of anthraquinone were synthesized, which exhibited an ability for DNA cleavage upon UV irradiation. Their structure-activity relationship was established, in which the most potent compound was anthraquinone O-9-(1,3-benzothiazole-2-carbonyl)oxime (4j). It can produce radical species and nick DNA at the concentration as low as 1.0 mu M. (c) 2008 Elsevier Ltd. All rights reserved.