(S)-5-(2-((tetrahydro-2H-pyran-4-yl)methyl)piperazin-1-yl)-1H-indazole | 1229446-91-6

• 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: (S)-5-(2-((tetrahydro-2H-pyran-4-yl)methyl)piperazin-1-yl)-1H-indazole
• 英文别名: 5-[(2S)-2-(oxan-4-ylmethyl)piperazin-1-yl]-1H-indazole
• CAS: 1229446-91-6
• 化学式: C₁₇H₂₄N₄O
• 分子量: 300.404
• InChiKey: ZJJWZZFPUVRGQQ-INIZCTEOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  53.2
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  5-[2-(tetrahydro-pyran-4-ylmethyl)-piperazin-1-yl]-1H-indazole 在 chiral SCF HPLC 作用下， 生成 (S)-5-(2-((tetrahydro-2H-pyran-4-yl)methyl)piperazin-1-yl)-1H-indazole 、 (R)-5-(2-((tetrahydro-2H-pyran-4-yl)methyl)piperazin-1-yl)-1H-indazole
  参考文献：
  名称：

  2-Substituted N-aryl piperazines as novel triple reuptake inhibitors for the treatment of depression

  摘要：

  Recently a class of compounds known as triple reuptake inhibitors has emerged as a new strategy for the treatment of depression. These compounds work by simultaneously inhibiting the synaptic reuptake of serotonin, norepinephrine and dopamine. In this Letter we describe the optimization of a novel series of 2-substituted N-aryl piperazine based triple reuptake inhibitors. (c) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.05.008

文献信息

• 2-Substituted N-aryl piperazines as novel triple reuptake inhibitors for the treatment of depression
  作者：David S. Carter、Hai-Ying Cai、Eun Kyung Lee、Pravin S. Iyer、Matthew C. Lucas、Ralf Roetz、Ryan C. Schoenfeld、Robert J. Weikert

  DOI：10.1016/j.bmcl.2010.05.008

  日期：2010.7

  Recently a class of compounds known as triple reuptake inhibitors has emerged as a new strategy for the treatment of depression. These compounds work by simultaneously inhibiting the synaptic reuptake of serotonin, norepinephrine and dopamine. In this Letter we describe the optimization of a novel series of 2-substituted N-aryl piperazine based triple reuptake inhibitors. (c) 2010 Elsevier Ltd. All rights reserved.