5-[7-[7-(2,3-Dihydrothieno[3,4-b][1,4]dioxin-5-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl]-7-[7-(7-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxine

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 双噻吩和低聚噻吩
• 英文名称: 5-[7-[7-(2,3-Dihydrothieno[3,4-b][1,4]dioxin-5-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl]-7-[7-(7-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxine
• 英文别名: 5-[7-[7-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl]-7-[7-(7-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxine
• 化学式: C₃₇H₂₈O₁₂S₆
• 分子量: 857.0
• InChiKey: IXMKMZYRUCWNGI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.2
• 重原子数：
  55
• 可旋转键数：
  5
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  280
• 氢给体数：
  0
• 氢受体数：
  18

文献信息

• METAL-BASED THIOPHENE PHOTODYNAMIC COMPOUNDS AND THEIR USE
  申请人：McFarland, Sherri Ann

  公开号：EP2854948B1

  公开（公告）日：2019-09-25
• METAL-BASED COORDINATION COMPLEXES AS PHOTODYNAMIC COMPOUNDS AND THEIR USE
  申请人：MCFARLAND Sherri Ann

  公开号：US20160039854A1

  公开（公告）日：2016-02-11

  Compositions of the invention include metal-based coordination complexes, which are preferably tunable photodynamic compounds. The compositions and complexes are useful as therapeutic agents and as in vivo diagnostic agents for treating or preventing diseases including those that involve hyperproliferating cells in their etiology, such as cancer. Compositions and complexes of the invention are further capable of destroying microbial cells, such as bacteria, fungi, and protozoa, and destroying viruses. The compositions and complexes are also capable of modulating cell function in other ways.
• US9345769B2
  申请人：——

  公开号：US9345769B2

  公开（公告）日：2016-05-24
• US9676806B2
  申请人：——

  公开号：US9676806B2

  公开（公告）日：2017-06-13
• [EN] METAL-BASED COORDINATION COMPLEXES AS PHOTODYNAMIC COMPOUNDS AND THEIR USE<br/>[FR] COMPLEXES DE COORDINATION A BASE DE MÉTAL EN TANT QUE COMPOSES PHOTODYNAMIQUES ET LEUR UTILISATION
  申请人：MCFARLAND SHERRI ANN

  公开号：WO2014145428A2

  公开（公告）日：2014-09-18

  Compositions of the invention include metal-based coordination complexes, which are preferably tunable photodynamic compounds. The compositions and complexes are useful as therapeutic agents and as in vivo diagnostic agents for treating or preventing diseases including those that involve hyperproliferating cells in their etiology, such as cancer. Compositions and complexes of the invention are further capable of destroying microbial cells, such as bacteria, fungi, and protozoa, and destroying viruses. The compositions and complexes are also capable of modulating cell function in other ways.