1,9-Bis{N-[2-(2,4-dichlorophenyl)ethyl]carbamoyl}-10,10-dioxo-phenoxathiin | 443794-71-6

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: 1,9-Bis{N-[2-(2,4-dichlorophenyl)ethyl]carbamoyl}-10,10-dioxo-phenoxathiin
• 英文别名: 1-N,9-N-bis[2-(2,4-dichlorophenyl)ethyl]-10,10-dioxophenoxathiine-1,9-dicarboxamide
• CAS: 443794-71-6
• 化学式: C₃₀H₂₂Cl₄N₂O₅S
• 分子量: 664.393
• InChiKey: KBMLKYGUUSHSQH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.3
• 重原子数：
  42
• 可旋转键数：
  8
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  110
• 氢给体数：
  2
• 氢受体数：
  5

文献信息

• Symmetrically disubstituted aromatic compounds and pharmaceutical compositions for inhibiting poly (ADP-ribose) glycohydrolase, and methods for their use
  申请人：——

  公开号：US20020132852A1

  公开（公告）日：2002-09-19

  Symmetrically disubstituted aromatic compounds and pharmaceutical compositions containing such compounds that inhibit and/or modulate the activity of poly(ADP-ribose) glycohydrolase, also known as PARG, are described. The invention is also directed to the therapeutic or prophylactic use of such compounds and compositions, and to methods of treating diseases and disorders described herein, by administering effective amounts of such compounds.

  描述了对称二取代芳香化合物和含有这种化合物的药物组合物，这些化合物抑制和/或调节聚(ADP核糖)甘油水解酶（也称为PARG）的活性。本发明还涉及使用这些化合物和组合物进行治疗或预防以及通过给予有效量的这些化合物来治疗本文描述的疾病和紊乱的方法。
• US6635786B2
  申请人：——

  公开号：US6635786B2

  公开（公告）日：2003-10-21