4,7-Dihydro-2-(4-morpholinylmethyl)-4-oxo-7-phenylfuro[2,3-b]pyridine-5-carboxylic acid ethyl ester | 562100-94-1

• 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: 4,7-Dihydro-2-(4-morpholinylmethyl)-4-oxo-7-phenylfuro[2,3-b]pyridine-5-carboxylic acid ethyl ester
• 英文别名: ethyl 2-(morpholin-4-ylmethyl)-4-oxo-7-phenylfuro[2,3-b]pyridine-5-carboxylate
• CAS: 562100-94-1
• 化学式: C₂₁H₂₂N₂O₅
• 分子量: 382.416
• InChiKey: QXYOJBGUZBVMGT-UHFFFAOYSA-N

物化性质

• 沸点：
  522.5±50.0 °C(Predicted)
• 密度：
  1.302±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  28
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  72.2
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  4,7-Dihydro-2-(4-morpholinylmethyl)-4-oxo-7-phenylfuro[2,3-b]pyridine-5-carboxylic acid ethyl ester 、 对氯苄胺 以 乙二醇 为溶剂， 生成 N-[(4-chlorophenyl)methyl]-2-(morpholin-4-ylmethyl)-4-oxo-7-phenylfuro[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：

  4,7-Dihydro-4-oxo-7-phenylfuro[2,3-b]pyridine-5-carboxylic acid ethyl ester 、 N-(methylene)morpholinium chloride 以 乙腈 为溶剂， 生成 4,7-Dihydro-2-(4-morpholinylmethyl)-4-oxo-7-phenylfuro[2,3-b]pyridine-5-carboxylic acid ethyl ester
  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。
• US6878705B2
  申请人：——

  公开号：US6878705B2

  公开（公告）日：2005-04-12