4-(pyridin-2-yl)-2-(pyridin-2-ylmethyl)thiazole | 1082506-02-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 4-(pyridin-2-yl)-2-(pyridin-2-ylmethyl)thiazole
• 英文别名: 2-(2-(Pyridin-2-ylmethyl)thiazol-4-yl)pyridine；4-pyridin-2-yl-2-(pyridin-2-ylmethyl)-1,3-thiazole
• CAS: 1082506-02-2
• 化学式: C₁₄H₁₁N₃S
• 分子量: 253.327
• InChiKey: PRDBWXKZNUDZAP-UHFFFAOYSA-N

物化性质

• 沸点：
  443.9±35.0 °C(predicted)
• 密度：
  1.246±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  66.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-吡啶硫代乙酰胺 、 2-溴-1-(2-吡啶基)-1-乙酮氢溴酸 以 N,N-二甲基甲酰胺 为溶剂， 反应 1.0h， 生成 4-(pyridin-2-yl)-2-(pyridin-2-ylmethyl)thiazole
  参考文献：
  名称：

  Initial SAR studies on apamin-displacing 2-aminothiazole blockers of calcium-activated small conductance potassium channels

  摘要：

  An initial SAR study on a series of apamin-displacing 2-aminothiazole K(Ca)2 channel blockers is described. Potent inhibitors such as N-(4-methylpyridin-2-yl)-4-(pyridin-2-yl) thiazol-2-amine (13) are disclosed, and for select members of the series, the relationship between the observed activity in a thallium flux, a binding and a whole-cell electrophysiology assay is presented. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.08.023

文献信息

• Initial SAR studies on apamin-displacing 2-aminothiazole blockers of calcium-activated small conductance potassium channels
  作者：Robert G. Gentles、Katherine Grant-Young、Shuanghua Hu、Yazhong Huang、Michael A. Poss、Charles Andres、Tracey Fiedler、Ronald Knox、Nicholas Lodge、C. David Weaver、David G. Harden

  DOI：10.1016/j.bmcl.2008.08.023

  日期：2008.10

  An initial SAR study on a series of apamin-displacing 2-aminothiazole K(Ca)2 channel blockers is described. Potent inhibitors such as N-(4-methylpyridin-2-yl)-4-(pyridin-2-yl) thiazol-2-amine (13) are disclosed, and for select members of the series, the relationship between the observed activity in a thallium flux, a binding and a whole-cell electrophysiology assay is presented. (c) 2008 Elsevier Ltd. All rights reserved.