2-(chloromethyl)-N-[(4-chlorophenyl)methyl]-7-[2-(diethylamino)ethyl]-4-oxofuro[2,3-b]pyridine-5-carboxamide | 562101-11-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 2-(chloromethyl)-N-[(4-chlorophenyl)methyl]-7-[2-(diethylamino)ethyl]-4-oxofuro[2,3-b]pyridine-5-carboxamide
• CAS: 562101-11-5
• 化学式: C₂₂H₂₅Cl₂N₃O₃
• 分子量: 450.365
• InChiKey: QDJJBYQXROKETQ-UHFFFAOYSA-N

物化性质

• 沸点：
  634.2±55.0 °C(Predicted)
• 密度：
  1.289±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  30
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  65.8
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  (R)-1-(2-furyl)-2-(methylamino)ethanol 、 2-(chloromethyl)-N-[(4-chlorophenyl)methyl]-7-[2-(diethylamino)ethyl]-4-oxofuro[2,3-b]pyridine-5-carboxamide 在 N,N-二异丙基乙胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 N-[(4-chlorophenyl)methyl]-7-[2-(diethylamino)ethyl]-2-[[[(2R)-2-(furan-2-yl)-2-hydroxyethyl]-methylamino]methyl]-4-oxofuro[2,3-b]pyridine-5-carboxamide
  参考文献：
  名称：

  Synthesis of 4-oxo-4,7-dihydrofuro[2,3-b]pyridine-5-carboxamides with broad-spectrum human herpesvirus polymerase inhibition

  摘要：

  A versatile synthesis of 4-oxo-4,7-dihydrofuro[2,3-b]pyridine-5-carboxylate esters has been developed which has lead to the identification of a new series of non-nucleoside inhibitors of human herpesvirus polymerases HCMV, HSV-1, EBV, and VZV with high specificity compared to human DNA polymerases. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.06.060
• 作为产物：
  描述：

  N-[(4-chlorophenyl)methyl]-7-[2-(diethylamino)ethyl]-2-(morpholin-4-ylmethyl)-4-oxofuro[2,3-b]pyridine-5-carboxamide 在 氯甲酸乙酯 作用下， 以 氯仿 为溶剂， 生成 2-(chloromethyl)-N-[(4-chlorophenyl)methyl]-7-[2-(diethylamino)ethyl]-4-oxofuro[2,3-b]pyridine-5-carboxamide
  参考文献：
  名称：

  Synthesis of 4-oxo-4,7-dihydrofuro[2,3-b]pyridine-5-carboxamides with broad-spectrum human herpesvirus polymerase inhibition

  摘要：

  A versatile synthesis of 4-oxo-4,7-dihydrofuro[2,3-b]pyridine-5-carboxylate esters has been developed which has lead to the identification of a new series of non-nucleoside inhibitors of human herpesvirus polymerases HCMV, HSV-1, EBV, and VZV with high specificity compared to human DNA polymerases. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.06.060

文献信息

• 4-OXO-4,7-DIHYDROFURO[2,3-B]PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS
  申请人：——

  公开号：US20040259907A1

  公开（公告）日：2004-12-23

  The invention provides a compound of formula I: 1 wherein G, R 2 , R 3 , and R 4 have any of the values defined in the specification, or a pharmaceutically acceptable salt thereof, as well as processes and intermediates useful for preparing such compounds or salts, and methods of treating a herpesvirus infection using such compounds or salts.

  该发明提供了公式I的化合物：1其中G、R2、R3和R4具有规范中定义的任何值，或其药学上可接受的盐，以及用于制备这种化合物或盐的过程和中间体，以及使用这种化合物或盐治疗疱疹病毒感染的方法。
• 4-OXO-4,7-DIHYDROFURO(2,3-B)PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS
  申请人：PHARMACIA & UPJOHN COMPANY

  公开号：EP1465895A2

  公开（公告）日：2004-10-13
• US6878705B2
  申请人：——

  公开号：US6878705B2

  公开（公告）日：2005-04-12
• [EN] 4-OXO-4, 7-DIHYDROFURO[2,3-b]PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS<br/>[FR] AGENTS ANTIVIRAUX 4-OXO-4, 7-DIHYDROFURO[2,3-B]PYRIDINE-5-CARBOXAMIDE
  申请人：UPJOHN CO

  公开号：WO2003059911A2

  公开（公告）日：2003-07-24

  The invention provides a compound of formula I: (I) Wherein G, R2, R3, and R4 have any of the values defined in the specification, or a pharmaceutically acceptable salt thereof, as well as processes and intermediates useful for preparing such compounds or salts, and methods of treating a herpesvirus infection using such compounds or salts.