propyl [(7R)-7-(methylamino)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl]acetate | 1219007-81-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: propyl [(7R)-7-(methylamino)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl]acetate
• 英文别名: propyl 2-[(7R)-7-(methylamino)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl]acetate
• CAS: 1219007-81-4
• 化学式: C₁₈H₂₄N₂O₂
• 分子量: 300.401
• InChiKey: DNTVRGJDFOXLKL-CYBMUJFWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  22
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  43.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  吡啶-2-磺酰氯 、 propyl [(7R)-7-(methylamino)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl]acetate 在 4-二甲氨基吡啶 、 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  Discovery of MK-7246, a selective CRTH2 antagonist for the treatment of respiratory diseases

  摘要：

  In this manuscript we wish to report the discovery of MK-7246 (4), a potent and selective CRTH2 (DP2) antagonist. SAR studies leading to MK-7246 along with two synthetic sequences enabling the preparation of this novel class of CRTH2 antagonist are reported. Finally, the pharmacokinetic and metabolic profile of MK-7246 is disclosed. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.11.015
• 作为产物：
  描述：

  propyl {(7R)-7-{[(4-fluorophenyl)sulfonyl](methyl)amino}-6,7,8,9-tetrahydro-pyrido[1,2-a]indol-10-yl}acetate 在 magnesium 作用下， 以 甲醇 为溶剂， 生成 propyl [(7R)-7-(methylamino)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl]acetate
  参考文献：
  名称：

  Discovery of MK-7246, a selective CRTH2 antagonist for the treatment of respiratory diseases

  摘要：

  In this manuscript we wish to report the discovery of MK-7246 (4), a potent and selective CRTH2 (DP2) antagonist. SAR studies leading to MK-7246 along with two synthetic sequences enabling the preparation of this novel class of CRTH2 antagonist are reported. Finally, the pharmacokinetic and metabolic profile of MK-7246 is disclosed. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.11.015

文献信息

• [EN] INDOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS<br/>[FR] DÉRIVÉS D'INDOLE COMME ANTAGONISTES DU RÉCEPTEUR CRTH2
  申请人：MERCK FROSST CANADA LTD

  公开号：WO2010031183A1

  公开（公告）日：2010-03-25

  Compound of formula I are antagonists of the PGD2 receptor, CRTH2, and as such are useful in the treatment and/or prevention of CRTH2-mediated diseases such as asthma.

  化合物I的拼合物是PGD2受体CRTH2的拮抗剂，因此在治疗和/或预防CRTH2介导的疾病如哮喘方面是有用的。
• INDOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS
  申请人：Colucci John

  公开号：US20110172263A1

  公开（公告）日：2011-07-14

  Compound of formula I are antagonists of the PGD2 receptor, CRTH2, and as such are useful in the treatment and/or prevention of CRTH2-mediated diseases such as asthma.

  I类化合物是PGD2受体CRTH2的拮抗剂，因此在治疗和/或预防CRTH2介导的疾病，如哮喘方面非常有用。
• Indole derivatives as CRTH2 receptor antagonists
  申请人：Colucci John

  公开号：US08637671B2

  公开（公告）日：2014-01-28

  Compound of formula I are antagonists of the PGD2 receptor, CRTH2, and as such are useful in the treatment and/or prevention of CRTH2-mediated diseases such as asthma.

  公式I的化合物是PGD2受体CRTH2的拮抗剂，因此在治疗和/或预防CRTH2介导的疾病，如哮喘方面有用。
• Discovery of MK-7246, a selective CRTH2 antagonist for the treatment of respiratory diseases
  作者：Michel Gallant、Christian Beaulieu、Carl Berthelette、John Colucci、Michael A. Crackower、Chad Dalton、Danielle Denis、Yves Ducharme、Richard W. Friesen、Daniel Guay、François G. Gervais、Martine Hamel、Robert Houle、Connie M. Krawczyk、Birgit Kosjek、Stephen Lau、Yves Leblanc、Ernest E. Lee、Jean-François Levesque、Christophe Mellon、Carmela Molinaro、Wayne Mullet、Gary P. O’Neill、Paul O’Shea、Nicole Sawyer、Susan Sillaots、Daniel Simard、Deborah Slipetz、Rino Stocco、Dan Sørensen、Vouy Linh Truong、Elizabeth Wong、Jin Wu、Helmi Zaghdane、Zhaoyin Wang

  DOI：10.1016/j.bmcl.2010.11.015

  日期：2011.1

  In this manuscript we wish to report the discovery of MK-7246 (4), a potent and selective CRTH2 (DP2) antagonist. SAR studies leading to MK-7246 along with two synthetic sequences enabling the preparation of this novel class of CRTH2 antagonist are reported. Finally, the pharmacokinetic and metabolic profile of MK-7246 is disclosed. (C) 2010 Elsevier Ltd. All rights reserved.