Benzo[c]thiophen-4(5H)-one, 6,7-dihydro-6,6-dimethyl-3-(methylthio)-, oxime

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: Benzo[c]thiophen-4(5H)-one, 6,7-dihydro-6,6-dimethyl-3-(methylthio)-, oxime
• 英文别名: (NE)-N-(6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-ylidene)hydroxylamine
• 化学式: C₁₁H₁₅NOS₂
• 分子量: 241.4
• InChiKey: MSRIAXHKDICKTA-XYOKQWHBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  86.1
• 氢给体数：
  1
• 氢受体数：
  4

文献信息

• Small Molecule Sensitization of BAX Activation for Induction of Cell Death
  申请人：Dana-Farber Cancer Institute, Inc.

  公开号：US20200172530A1

  公开（公告）日：2020-06-04

  Provided herein are compositions comprising a compound of Formulas I, II, or III, and compositions a compound comprising a moiety of Formula IV, which are useful for sensitizing and/or activating pro-apoptotic activity of BAX. Methods of treating diseases associated with BAX (e.g., cancer) and methods of identifying compounds which sensitize and/or activate the pro-apoptotic activity of a BAX polypeptide are also provided.