3-cyclopentyl-8-(2,6-difluorophenyl)-5-methyl-2-(2-methyl-2H-[1,2,4]triazol-3-ylmethoxy)imidazo[1,2-d][1,2,4]triazine | 327985-55-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并[1，2-d][1，2，4]三嗪
• 英文名称: 3-cyclopentyl-8-(2,6-difluorophenyl)-5-methyl-2-(2-methyl-2H-[1,2,4]triazol-3-ylmethoxy)imidazo[1,2-d][1,2,4]triazine
• 英文别名: 3-Cyclopentyl-8-(2,6-difluorophenyl)-5-methyl-2-[(2-methyl-1,2,4-triazol-3-yl)methoxy]imidazo[1,2-d][1,2,4]triazine
• CAS: 327985-55-7
• 化学式: C₂₁H₂₁F₂N₇O
• 分子量: 425.441
• InChiKey: OLGQVQLSQDOCAI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  31
• 可旋转键数：
  5
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  83
• 氢给体数：
  0
• 氢受体数：
  8

文献信息

• IMIDAZO-TRIAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS
  申请人：MERCK SHARP & DOHME LTD.

  公开号：EP1212324A1

  公开（公告）日：2002-06-12
• US6608062B1
  申请人：——

  公开号：US6608062B1

  公开（公告）日：2003-08-19
• [EN] IMIDAZO-TRIAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS<br/>[FR] DERIVES D'IMIDAZO-TRIAZINE UTILES COMME LIGANDS DE RECEPTEURS GABA
  申请人：MERCK SHARP & DOHME

  公开号：WO2001014377A1

  公开（公告）日：2001-03-01

  A class of substituted imidazo[1,2-d][1,2,4]triazine derivatives, possessing an optionally substituted cycloalkyl, phenyl or heteroaryl substituent at the 8-position, a substituted alkoxy moiety at the 2-position, a range of substituents at the 3-position and an optional alkyl or cycloalkyl substituent at the 5-position, are selective ligands for GABAA receptors, in particular having high affinity for the α2 and/or α3 subunit thereof, and are accordingly of benefit in the treatment and/or prevention of disorders of the central nervous system, including anxiety and convulsions.