N-(4-(4-methylpiperazin-1-yl)phenyl)-6-phenylquinolin-4-amine | 144653-43-0

• 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: N-(4-(4-methylpiperazin-1-yl)phenyl)-6-phenylquinolin-4-amine
• 英文别名: N-[4-(4-methylpiperazin-1-yl)phenyl]-6-phenylquinolin-4-amine
• CAS: 144653-43-0
• 化学式: C₂₆H₂₆N₄
• 分子量: 394.519
• InChiKey: YMBNETKULXIEPR-UHFFFAOYSA-N

物化性质

• 沸点：
  584.8±50.0 °C(Predicted)
• 密度：
  1.190±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.3
• 重原子数：
  30
• 可旋转键数：
  4
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  31.4
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  4-chloro-6-phenylquinoline 、 4-(4-甲基哌嗪)苯胺 以 N-甲基吡咯烷酮 为溶剂， 生成 N-(4-(4-methylpiperazin-1-yl)phenyl)-6-phenylquinolin-4-amine
  参考文献：
  名称：

  4-Anilino-6-phenyl-quinoline inhibitors of mitogen activated protein kinase-activated protein kinase 2 (MK2)

  摘要：

  A class of inhibitors of mitogen activated protein kinase-activated kinase 2 (MK2) was discovered via high-throughput screening. This compound class demonstrates activity against the enzyme with sub-mu M IC(50) values, and suppresses LPS-induced TNF alpha levels in THP-1 cells. MK2 inhibition kinetic measurements indicated mixed binding approaching non-ATP competitive inhibition. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.06.107

文献信息

• [EN] QUINOLINE- AND ISOQUINOLINE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF<br/>[FR] COMPOSES A BASE DE QUINOLEINE ET D'ISOQUINOLEINE PRESENTANT UNE ACTIVITE D'INHIBITION D'ENZYMES UTILISANT DE L'ATP ET COMPOSITIONS ET UTILISATIONS DE CEUX-CI
  申请人：AMPHORA DISCOVERY CORP

  公开号：WO2005120509A1

  公开（公告）日：2005-12-22

  Quinoline- and isoquinoline-based compounds exhibiting ATP-utilizing enzyme inhibitory activity, methods of using compounds exhibiting ATP-utilizing enzyme inhibitory activity, and compositions comprising compounds exhibiting ATP-utilizing enzyme inhibitory activity, are disclosed.

  揭示了基于喹啉和异喹啉的化合物展现出ATP利用酶抑制活性，以及使用展现出ATP利用酶抑制活性的化合物的方法和包含这些化合物的组合物。
• Quinoline- and isoquinoline-based compounds exhibiting ATP-utilizing enzyme inhibitory activity, and compositions, and uses thereof
  申请人：Dickson K. John

  公开号：US20060009460A1

  公开（公告）日：2006-01-12

  Quinoline- and isoquinoline-based compounds exhibiting ATP-utilizing enzyme inhibitory activity, methods of using compounds exhibiting ATP-utilizing enzyme inhibitory activity, and compositions comprising compounds exhibiting ATP-utilizing enzyme inhibitory activity, are disclosed.

  本发明公开了基于喹啉和异喹啉的化合物，展现出ATP利用酶抑制活性，公开了使用展现出ATP利用酶抑制活性的化合物的方法，并公开了包含展现出ATP利用酶抑制活性的化合物的组合物。
• Method for predicting skin sensitizing activity of compounds
  申请人：Dickson, JR. John K.

  公开号：US20090069338A1

  公开（公告）日：2009-03-12

  Quinoline- and isoquinoline-based compounds exhibiting ATP-utilizing enzyme inhibitory activity, methods of using compounds exhibiting ATP-utilizing enzyme inhibitory activity, and compositions comprising compounds exhibiting ATP-utilizing enzyme inhibitory activity, are disclosed.

  本发明揭示了基于喹啉和异喹啉的化合物，这些化合物表现出ATP利用酶抑制活性，以及使用表现出ATP利用酶抑制活性的化合物的方法和包含表现出ATP利用酶抑制活性的化合物的组合物。
• QUINOLINE- AND ISOQUINOLINE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF
  申请人：Amphora Discovery Corporation

  公开号：EP1781293A1

  公开（公告）日：2007-05-09
• US7452887B2
  申请人：——

  公开号：US7452887B2

  公开（公告）日：2008-11-18