(±)-cis-N-[1-(4-methoxy-benzoyl)-2-methyl-1,2,3,4-tetrahydro-quinolin-4-yl]-N-phenyl-ethanamide | 1202402-34-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: (±)-cis-N-[1-(4-methoxy-benzoyl)-2-methyl-1,2,3,4-tetrahydro-quinolin-4-yl]-N-phenyl-ethanamide
• 英文别名: (±)-cis-N-[1-(4-methoxy-benzoyl)-2-methyl-1,2,3,4-tetrahydro-quinolin-4-yl]-N-phenyl-acetamide；(±)-Cis-N-[1-(4-methoxy-benzoyl)-2-methyl-1,2,3,4-tetrahydro-quinolin-4-yl]-N-phenyl-acetamide；(+)-Cis-N-[1-(4-methoxy-benzoyl)-2-methyl-1,2,3,4-tetrahydro-quinolin-4-yl]-N-phenyl-acetamide；N-[(2R,4S)-1-(4-methoxybenzoyl)-2-methyl-3,4-dihydro-2H-quinolin-4-yl]-N-phenylacetamide
• CAS: 1202402-34-3
• 化学式: C₂₆H₂₆N₂O₃
• 分子量: 414.504
• InChiKey: GOLMJSAAQDYQPW-CJAUYULYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  31
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  49.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  对甲氧基苯甲酰氯 、 N-[(2S,4R)-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl]-N-phenylacetamide 在 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 反应 20.0h， 以85%的产率得到(±)-cis-N-[1-(4-methoxy-benzoyl)-2-methyl-1,2,3,4-tetrahydro-quinolin-4-yl]-N-phenyl-ethanamide
  参考文献：
  名称：

  Tetrahydroquinoline derivatives as CRTH2 antagonists

  摘要：

  A series of tetrahydroquinoline-derived inhibitors of the CRTH2 receptor was discovered by a high throughput screen. Optimization of these compounds for potency and pharmacokinetic properties led to the discovery of potent and orally bioavailable CRTH2 antagonists. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.10.094

文献信息

• Quinoline derivatives as CRTH2 antagonists
  申请人：Warner-Lambert Company LLC

  公开号：EP1435356A1

  公开（公告）日：2004-07-07

  The invention relates to compounds of formula (I) wherein R1, R2, R3, R4, R5, R6, R7 and R8 are as defined in the description, their use as medicament, pharmaceutical compositions containing them and processes for their preparation.

  该发明涉及公式（I）中R1、R2、R3、R4、R5、R6、R7和R8的化合物，其用作药物、含有它们的药物组合物以及它们的制备方法。
• PGD2 receptor antagonists for the treatment of inflammatory diseases
  申请人：Ghosh Shomir

  公开号：US20050256158A1

  公开（公告）日：2005-11-17

  Disclosed herein are compounds represented by Structural Formula (I) and (I-A): Also disclosed is the use of such compounds for inhibiting the G-protein coupled receptor referred to as chemoattractant receptor-homologous molecule expressed on Th2, or simply “CRTH2” for the treatment of inflammatory disorders. The variables in Structural Formula (I) and (I-A) are defined herein.

  本文揭示了由结构式（I）和（I-A）表示的化合物：还披露了利用这些化合物抑制称为Th2表达的G蛋白偶联受体的化学引诱受体同源分子，简称“CRTH2”，用于治疗炎症性疾病。结构式（I）和（I-A）中的变量在此处被定义。
• Quinoline Derivatives as CRTH2 Antagonists
  申请人：Ali Awad M. Mohamed

  公开号：US20070197587A1

  公开（公告）日：2007-08-23

  The invention relates to compounds of formula (I) wherein R 1 , R 2 , R 3 , R 4 , R 5 , R 6 , R 7 and R 8 are as defined in the description, their use as medicament, pharmaceutical compositions containing them and processes for their preparation.

  该发明涉及式(I)的化合物，其中R1、R2、R3、R4、R5、R6、R7和R8如描述中所定义，它们作为药物的用途、含有它们的制药组合物以及它们的制备方法。
• TETRAHYDROQUINOLINE DERIVATIVES AS CRTH2 ANTAGONISTS
  申请人：Warner-Lambert Company LLC

  公开号：EP1556356A1

  公开（公告）日：2005-07-27
• US7211672B2
  申请人：——

  公开号：US7211672B2

  公开（公告）日：2007-05-01