2-[[5-[(3-chloro-4-methylanilino)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-ylacetamide

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 2-[[5-[(3-chloro-4-methylanilino)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-ylacetamide
• 化学式: C₂₃H₂₂ClN₅OS
• 分子量: 452.0
• InChiKey: MXKMASLIZZBEGY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  31
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  97.1
• 氢给体数：
  2
• 氢受体数：
  5

文献信息

• MODULATORS OF RETINOID-RELATED ORPHAN RECEPTOR GAMMA
  申请人：Orphagen Pharmaceuticals, Inc.

  公开号：US20170267712A1

  公开（公告）日：2017-09-21

  Methods for modulating (inhibiting or stimulating) retinoid-related orphan receptor γ (RORγ) activity. This modulation has numerous effects, including inhibition of T H -17 cell function and/or T H -17 cell activity, and inhibition of re-stimulation of T H -17 cells, which are beneficial to treatment of inflammation and autoimmune disorders. Stimulation of RORγ results in stimulation of T H -17 cell function and/or activity which is beneficial for immune-enhancing compositions (e.g., vaccines).