tert-butyl N-[1-[3-[(5-chloronaphthalen-1-yl)sulfonylmethyl]-4-nitrophenyl]piperidin-4-yl]carbamate | 1232361-07-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: tert-butyl N-[1-[3-[(5-chloronaphthalen-1-yl)sulfonylmethyl]-4-nitrophenyl]piperidin-4-yl]carbamate
• CAS: 1232361-07-7
• 化学式: C₂₇H₃₀ClN₃O₆S
• 分子量: 560.071
• InChiKey: DQTNJPZHOSUWLX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.7
• 重原子数：
  38
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  130
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  tert-butyl N-[1-[4-amino-3-[(5-chloronaphthalen-1-yl)sulfonylmethyl]phenyl]piperidin-4-yl]carbamate 在 10% palladium on carbon 、 氢气 作用下， 生成 tert-butyl N-[1-[3-[(5-chloronaphthalen-1-yl)sulfonylmethyl]-4-nitrophenyl]piperidin-4-yl]carbamate
  参考文献：
  名称：

  5-Cyclic Amine-3-arylsulfonylindazoles as Novel 5-HT₆ Receptor Antagonists

  摘要：

  Novel 5-cyclic amine-3-arylsulfonylindazoles were prepared, and several analogues within this class have been identified as high-affinity 5-HT6 receptor ligands with improved pharmacokinetic and pharmacological properties. One selected example, 18b, showed good brain penetrability and a generally favorable pharmacokinetic profile with procognitive efficacy in the rat novel object recognition assay. The synthesis and structure activity relationship of this potent class are discussed.

  DOI：

  10.1021/jm901674f

文献信息

• 5-Cyclic Amine-3-arylsulfonylindazoles as Novel 5-HT₆ Receptor Antagonists
  作者：Simon N. Haydar、Heedong Yun、Patrick M. Andrae、James Mattes、Jean Zhang、Angela Kramer、Deborah L. Smith、Christine Huselton、Radka Graf、Suzan Aschmies、Lee E. Schechter、Thomas A. Comery、Albert J. Robichaud

  DOI：10.1021/jm901674f

  日期：2010.3.25

  Novel 5-cyclic amine-3-arylsulfonylindazoles were prepared, and several analogues within this class have been identified as high-affinity 5-HT6 receptor ligands with improved pharmacokinetic and pharmacological properties. One selected example, 18b, showed good brain penetrability and a generally favorable pharmacokinetic profile with procognitive efficacy in the rat novel object recognition assay. The synthesis and structure activity relationship of this potent class are discussed.