pyridazine-3,4,6-triol | 30480-35-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: pyridazine-3,4,6-triol
• 英文别名: 4-Hydroxy-1,2-dihydropyridazine-3,6-dione；4-hydroxy-1,2-dihydropyridazine-3,6-dione
• CAS: 30480-35-4
• 化学式: C₄H₄N₂O₃
• 分子量: 128.087
• InChiKey: ZQIGFOZNQXGCMO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.1
• 重原子数：
  9
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  78.4
• 氢给体数：
  3
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  pyridazine-3,4,6-triol 在 三氯氧磷 作用下， 生成 3,4,6-三氯哒嗪
  参考文献：
  名称：

  Investigation of the pyrazinones as PDE5 inhibitors: Evaluation of regioisomeric projections into the solvent region

  摘要：

  We describe the design, synthesis and profiling of a novel series of PDE5 inhibitors. We take advantage of an alternate projection into the solvent region to identify compounds with excellent potency, selectivity and pharmacokinetic profiles. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.08.106

文献信息

• Investigation of the pyrazinones as PDE5 inhibitors: Evaluation of regioisomeric projections into the solvent region
  作者：Robert O. Hughes、Todd Maddux、D. Joseph Rogier、Sharon Lu、John K. Walker、E. Jon Jacobsen、Jeanne M. Rumsey、Yi Zheng、Alan MacInnes、Brian R. Bond、Seungil Han

  DOI：10.1016/j.bmcl.2011.08.106

  日期：2011.11

  We describe the design, synthesis and profiling of a novel series of PDE5 inhibitors. We take advantage of an alternate projection into the solvent region to identify compounds with excellent potency, selectivity and pharmacokinetic profiles. (C) 2011 Elsevier Ltd. All rights reserved.