5-(2-methylpropanoyloxymethyl)-3-(4-trifluoromethylphenylamino)-7-(3-trifluoromethyl-2-pyridyl)-[1,2,4]triazolo[4,3-b]pyridazinium chloride | 863507-91-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 5-(2-methylpropanoyloxymethyl)-3-(4-trifluoromethylphenylamino)-7-(3-trifluoromethyl-2-pyridyl)-[1,2,4]triazolo[4,3-b]pyridazinium chloride
• 英文别名: [3-[4-(Trifluoromethyl)anilino]-7-[3-(trifluoromethyl)pyridin-2-yl]-[1,2,4]triazolo[4,3-b]pyridazin-5-ium-5-yl]methyl 2-methylpropanoate;chloride
• CAS: 863507-91-9
• 化学式: C₂₃H₁₉F₆N₆O₂*Cl
• 分子量: 560.886
• InChiKey: FAKPOQWTYNXRNK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.02
• 重原子数：
  38
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  85.3
• 氢给体数：
  1
• 氢受体数：
  13

文献信息

• [EN] PRODRUGS OF SUBSTITUTED AMINO HETEROBICYCLES WHICH MODULATE THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1)<br/>[FR] PROMEDICAMENTS D'HETEROBICYCLES AMINO SUBSTITUES DESTINES A LA MODULATION DE LA FONCTION DU RECEPTEUR VANILLOIDE 1 (VR1)
  申请人：MERCK SHARP & DOHME

  公开号：WO2005080391A1

  公开（公告）日：2005-09-01

  Compounds of formula (I) which are useful as therapeutic compounds, particularly in the treatment of pain and other conditions ameliorated by the modulation of the function of the vanilloid-1 receptor (VR1).

  式(I)的化合物可用作治疗化合物，特别是在治疗疼痛和其他通过调节辣椒素-1受体（VR1）功能而改善的症状方面。
• Prodrugs Of Substituted Amino Heterobicycles Which Modulate The Function Of The Vanilloid-1 Receptor (Vr1)
  申请人：Burkamp Frank

  公开号：US20070213332A1

  公开（公告）日：2007-09-13

  Compounds of formula (I) which are useful as therapeutic compounds, particularly in the treatment of pain and other conditions ameliorated by the modulation of the function of the vanilloid-1 receptor (VR1).

  化学式为（I）的化合物可用作治疗化合物，特别是在调节vanilloid-1受体（VR1）功能的情况下，用于治疗疼痛和其他病症的改善。
• PRODRUGS OF SUBSTITUTED AMINO HETEROBICYCLES WHICH MODULATE THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1)
  申请人：Merck Sharp & Dohme Limited

  公开号：EP1718647A1

  公开（公告）日：2006-11-08