1-(3,5-Bis-bromomethyl-phenyl)-ethanone | 544467-01-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-(3,5-Bis-bromomethyl-phenyl)-ethanone
• 英文别名: 1-[3,5-Bis(bromomethyl)phenyl]-ethanone；1-[3,5-bis(bromomethyl)phenyl]ethanone
• CAS: 544467-01-8
• 化学式: C₁₀H₁₀Br₂O
• 分子量: 305.997
• InChiKey: JLOMZJVCASLRBQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  13
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  1-(3,5-Bis-bromomethyl-phenyl)-ethanone 在 sodium azide 作用下， 以 水 、 丙酮 为溶剂， 生成 1-[3,5-Bis(azidomethyl)phenyl]ethanone
  参考文献：
  名称：

  Azido-Containing aryl β-Diketo acid HIV-1 integrase inhibitors

  摘要：

  Aryl beta-diketo acids (ADK) comprise a general class of potent HIV-1 integrase (IN) inhibitors, which can exhibit selective inhibition of strand transfer reactions in extracellular recombinant IN assays and provide potent antiviral effects in HIV-infected cells. Recent studies have shown that polycyclic aryl or aryl rings bearing aryl-containing substituents are components of potent members of this class. Reported herein is the first use of azido functionality as an aryl replacement in beta-diketo acid IN inhibitors. The ability of azido-containing inhibitors to exhibit potent inhibition of IN and antiviral protection in HIV-infected cells, renders the azide group of potential value in the further development of ADK-based IN inhibitors. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(03)00059-3
• 作为产物：
  描述：

  3,5-dimethylacetophenone 在 N-溴代丁二酰亚胺(NBS) 、 过氧化苯甲酰 作用下， 以 四氯化碳 为溶剂， 生成 1-(3,5-Bis-bromomethyl-phenyl)-ethanone
  参考文献：
  名称：

  Azido-Containing aryl β-Diketo acid HIV-1 integrase inhibitors

  摘要：

  Aryl beta-diketo acids (ADK) comprise a general class of potent HIV-1 integrase (IN) inhibitors, which can exhibit selective inhibition of strand transfer reactions in extracellular recombinant IN assays and provide potent antiviral effects in HIV-infected cells. Recent studies have shown that polycyclic aryl or aryl rings bearing aryl-containing substituents are components of potent members of this class. Reported herein is the first use of azido functionality as an aryl replacement in beta-diketo acid IN inhibitors. The ability of azido-containing inhibitors to exhibit potent inhibition of IN and antiviral protection in HIV-infected cells, renders the azide group of potential value in the further development of ADK-based IN inhibitors. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(03)00059-3

文献信息

• 一种氟化aza-BODIPY衍生物及其合成方法和应用
  申请人：中国科学院精密测量科学与技术创新研究院

  公开号：CN117820344A

  公开（公告）日：2024-04-05

  本发明公开了一种氟化aza‑BODIPY衍生物及其合成方法和应用，通过向aza‑BODIPY分子中对称地引入具有9个等价氟的全氟叔丁氧基(PFTBO)基团，不仅能高灵敏度地进行19F MRI成像，而且大体积的PFTBO基团还可以有效缓解氟化aza‑BODIPY分子的聚集，提高其光动力治疗(PDT)和荧光成像(FLI)能力。此外，借助PFTBO较强的疏水性和疏酯性，氟化aza‑BODIPY在细胞摄取时容易被锚定在细胞膜上，实现细胞膜靶向。因此，将PFTBO基团引入aza‑BODIPY分子中，能有效实现靶向肿瘤细胞膜的19F MRI和NIR FLI双模态成像引导的光热和光动力治疗。