2-{[3-cyano-4-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl}-N,N-diethylacetamide

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 2-{[3-cyano-4-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl}-N,N-diethylacetamide
• 英文别名: 2-[[3-cyano-4-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl]-N,N-diethylacetamide
• 化学式: C₁₆H₁₈F₃N₃OS
• 分子量: 357.4
• InChiKey: IUIAVDFHJJYZJL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  24
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  82.3
• 氢给体数：
  0
• 氢受体数：
  7

文献信息

• METHODS TO IDENTIFY INHIBITORS OF THE UNFOLDED PROTEIN RESPONSE
  申请人：Koong Albert C.

  公开号：US20090291857A1

  公开（公告）日：2009-11-26

  Methods for identifying compounds that are inhibitors of the unfolded protein response are provided. In particular, the methods identify compounds that inhibit the activity of IRE1.
• INHIBITORS OF THE UNFOLDED PROTEIN RESPONSE AND METHODS FOR THEIR USE
  申请人：Koong Albert C.

  公开号：US20090312362A1

  公开（公告）日：2009-12-17

  Compounds that are inhibitors of the unfolded protein response and endonuclease IRE1 are provided, together with compositions comprising such compounds, and methods for their use in the treatment of various disorders, such as cancer, autoimmune disorders, and diabetes. Also provided are packaged pharmaceuticals comprising these compositions. The compositions may be administered in combination with another therapeutic agent.
• US8372861B2
  申请人：——

  公开号：US8372861B2

  公开（公告）日：2013-02-12