5-Bromo-2-(4-propoxyphenoxy)pyridine | 1293142-86-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 5-Bromo-2-(4-propoxyphenoxy)pyridine
• CAS: 1293142-86-5
• 化学式: C₁₄H₁₄BrNO₂
• mdl: MFCD13476943
• 分子量: 308.175
• InChiKey: SWNVEVPYWUCNAK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  18
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.214
• 拓扑面积：
  31.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  5-Bromo-2-(4-propoxyphenoxy)pyridine 、 4-乙酰基苯硼酸 在 potassium phosphate 、 四(三苯基膦)钯 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 16.0h， 生成
  参考文献：
  名称：

  Potent biphenyl- and 3-phenyl pyridine-based inhibitors of acetyl-CoA carboxylase

  摘要：

  We report the synthesis and enzymatic evaluation of potent inhibitors of acetyl-CoA carboxylases (ACCs) containing biphenyl or 3-phenyl pyridine cores. These compounds inhibit both ACC1 and ACC2, or are moderately selective for either enzyme, depending on side chain substitution. Typical activities of the most potent compounds in this class are in the low double-digit to single-digit nanomolar range in in vitro assays using human ACC1 and ACC2 enzymes. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.08.077
• 作为产物：
  描述：

  4-丙氧基苯酚 、 5-溴-2-碘吡啶 在 copper(l) iodide 、 N,N-二甲基甘氨酸盐酸盐 、 caesium carbonate 作用下， 以 1,4-二氧六环 为溶剂， 反应 16.0h， 生成 5-Bromo-2-(4-propoxyphenoxy)pyridine
  参考文献：
  名称：

  Potent biphenyl- and 3-phenyl pyridine-based inhibitors of acetyl-CoA carboxylase

  摘要：

  We report the synthesis and enzymatic evaluation of potent inhibitors of acetyl-CoA carboxylases (ACCs) containing biphenyl or 3-phenyl pyridine cores. These compounds inhibit both ACC1 and ACC2, or are moderately selective for either enzyme, depending on side chain substitution. Typical activities of the most potent compounds in this class are in the low double-digit to single-digit nanomolar range in in vitro assays using human ACC1 and ACC2 enzymes. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.08.077