1-(1-Adamantyl)-2-(3-butyl-2-iminobenzimidazol-1-yl)ethanone

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 1-(1-Adamantyl)-2-(3-butyl-2-iminobenzimidazol-1-yl)ethanone
• 化学式: C₂₃H₃₁N₃O
• 分子量: 365.5
• InChiKey: YEYQOQQSSSKEFI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  27
• 可旋转键数：
  6
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  47.4
• 氢给体数：
  1
• 氢受体数：
  2

文献信息

• BICYCLIC HETEROCYCLES CAPABLE OF MODULATING T-CELL RESPONSES, AND METHODS OF USING SAME
  申请人：Nogra Pharma Limited

  公开号：US20150126553A1

  公开（公告）日：2015-05-07

  The present disclosure is directed in part to bicyclic heterocycles, such as a compound represented by formula (I) or (II) as disclosed herein, and their use in treating medical disorders, such as immune inflammatory disorders such as Crohn's disease, ulcerative colitis, rheumatic disorders, psoriasis, and allergies. The compounds are contemplated to modulate T-Cell responses.