[(3S,4R)-1-(3-chloro-benzenesulfonyl)-4-o-tolyl-piperidin-3-yl]-[4-(5-chloro-2-methyl-phenyl)-piperazin-1-yl]-methanone | 1118968-23-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: [(3S,4R)-1-(3-chloro-benzenesulfonyl)-4-o-tolyl-piperidin-3-yl]-[4-(5-chloro-2-methyl-phenyl)-piperazin-1-yl]-methanone
• 英文别名: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-[(3S,4R)-1-(3-chlorophenyl)sulfonyl-4-(2-methylphenyl)piperidin-3-yl]methanone
• CAS: 1118968-23-2
• 化学式: C₃₀H₃₃Cl₂N₃O₃S
• 分子量: 586.582
• InChiKey: MRNJAXWGSMEYPG-WUFINQPMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6
• 重原子数：
  39
• 可旋转键数：
  5
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  69.3
• 氢给体数：
  0
• 氢受体数：
  5

文献信息

• PIPERAZINE AMIDE DERIVATIVES
  申请人：Dehmlow Henrietta

  公开号：US20090048264A1

  公开（公告）日：2009-02-19

  The invention is concerned with novel piperazine amide derivatives of formula (I) wherein R 1 to R 11 , W, X and Y are as defined in the description and in the claims, as well as physiologically acceptable salts thereof. These compounds bind to LXR alpha and LXR beta and can be used as medicaments.

  这项发明涉及一种新型哌嗪酰胺衍生物，其化学式为（I），其中R1至R11、W、X和Y如描述和索赔中定义，并且其生理上可接受的盐。这些化合物能够结合到LXRα和LXRβ，并可用作药物。
• NOVEL PIPERAZINE AMIDE DERIVATIVES
  申请人：F. Hoffmann-La Roche AG

  公开号：EP2188266A2

  公开（公告）日：2010-05-26
• Novel piperazine amide derivatives
  申请人：F. Hoffmann-La Roche AG

  公开号：EP2188266B1

  公开（公告）日：2012-10-17
• US8288541B2
  申请人：——

  公开号：US8288541B2

  公开（公告）日：2012-10-16
• [EN] NOVEL PIPERAZINE AMIDE DERIVATIVES<br/>[FR] NOUVEAUX DÉRIVÉS AMIDES DE LA PIPÉRAZINE
  申请人：HOFFMANN LA ROCHE

  公开号：WO2009021868A2

  公开（公告）日：2009-02-19

  The invention is concerned with novel piperazine amide derivatives of formula (I) wherein R1 to R11, W, X and Y are as defined in the description and in the claims, as well as physiologically acceptable salts thereof. These compounds bind to LXR alpha and LXR beta and can be used as medicaments.