6-fluoro-4-(4-(phenylthio)phenylamino)-1,7-naphthyridine-3-carbonitrile | 871306-94-4

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 6-fluoro-4-(4-(phenylthio)phenylamino)-1,7-naphthyridine-3-carbonitrile
• 英文别名: 6-Fluoro-4-(4-phenylsulfanylanilino)-1,7-naphthyridine-3-carbonitrile
• CAS: 871306-94-4
• 化学式: C₂₁H₁₃FN₄S
• 分子量: 372.425
• InChiKey: QTCILYIEHYVBJL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  27
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  86.9
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  6-fluoro-4-(4-(phenylthio)phenylamino)-1,7-naphthyridine-3-carbonitrile 、 N-(2-氨基乙基)吗啉 以 四氢呋喃 为溶剂， 生成 6-(2-morpholinoethylamino)-4-(4-(phenylthio)phenylamino)-1,7-naphthyridine-3-carbonitrile
  参考文献：
  名称：

  Inhibition of Tpl2 kinase and TNF-α production with 1,7-naphthyridine-3-carbonitriles: Synthesis and structure–activity relationships

  摘要：

  The synthesis and structure-activity studies of a series of 6-substituted-4-anilino-[1,7]-naphthyridine-3-carbonitriles as inhibitors of Tpl2 kinase are described. The early exploratory work described here may lead to the discovery of compounds with significant therapeutic potential for treating rheumatoid arthritis and other inflammatory diseases. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.08.029
• 作为产物：
  描述：

  4-氨基二苯基硫化物 、 4-氯-6-氟-1,7-萘啶-3-甲腈 以 乙二醇乙醚 为溶剂， 生成 6-fluoro-4-(4-(phenylthio)phenylamino)-1,7-naphthyridine-3-carbonitrile
  参考文献：
  名称：

  Inhibition of Tpl2 kinase and TNF-α production with 1,7-naphthyridine-3-carbonitriles: Synthesis and structure–activity relationships

  摘要：

  The synthesis and structure-activity studies of a series of 6-substituted-4-anilino-[1,7]-naphthyridine-3-carbonitriles as inhibitors of Tpl2 kinase are described. The early exploratory work described here may lead to the discovery of compounds with significant therapeutic potential for treating rheumatoid arthritis and other inflammatory diseases. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.08.029

文献信息

• 4,6-diamino-[1,7]naphthyridine-3-carbonitrile inhibitors of Tpl2 kinase and methods of making and using the same
  申请人：Green Jeffrey Neal

  公开号：US20060276498A1

  公开（公告）日：2006-12-07

  The present invention provides compounds of formula (I): and pharmaceutically acceptable salts thereof, wherein R 1 , R 2 , R 3 , R 4 , R 5 , R 6 , m and n are defined as described herein. The invention also provides methods of making the compounds of formula (I), and methods of treating inflammatory diseases, such as rheumatoid arthritis, in a mammal comprising administering a therapeutically effective amount of a compound of formula (I) to the mammal.

  本发明提供了式(I)化合物及其药学上可接受的盐，其中R1、R2、R3、R4、R5、R6、m和n的定义如本文所述。本发明还提供了制备式(I)化合物的方法，以及治疗哺乳动物的炎症性疾病，如类风湿性关节炎的方法，包括向哺乳动物施用式(I)化合物的治疗有效量。
• US7432279B2
  申请人：——

  公开号：US7432279B2

  公开（公告）日：2008-10-07
• Inhibition of Tpl2 kinase and TNF-α production with 1,7-naphthyridine-3-carbonitriles: Synthesis and structure–activity relationships
  作者：Lori Krim Gavrin、Neal Green、Yonghan Hu、Kristin Janz、Neelu Kaila、Huan-Qiu Li、Steve Y. Tam、Jennifer R. Thomason、Ariamala Gopalsamy、Greg Ciszewski、John W. Cuozzo、J. Perry Hall、Sang Hsu、Jean-Baptiste Telliez、Lih-Ling Lin

  DOI：10.1016/j.bmcl.2005.08.029

  日期：2005.12

  The synthesis and structure-activity studies of a series of 6-substituted-4-anilino-[1,7]-naphthyridine-3-carbonitriles as inhibitors of Tpl2 kinase are described. The early exploratory work described here may lead to the discovery of compounds with significant therapeutic potential for treating rheumatoid arthritis and other inflammatory diseases. (c) 2005 Elsevier Ltd. All rights reserved.