3-氨基-4-乙酰氨基-2,6-二氯吡啶 | 668268-66-4

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 3-氨基-4-乙酰氨基-2,6-二氯吡啶
• 英文名称: 3-amino-4-acetamido-2,6-dichloropyridine
• 英文别名: N-(3-amino-2,6-dichloropyridin-4-yl)acetamide
• CAS: 668268-66-4
• 化学式: C₇H₇Cl₂N₃O
• 分子量: 220.058
• InChiKey: RTRGUCSKEYGVKD-UHFFFAOYSA-N

物化性质

• 沸点：
  447.7±45.0 °C(Predicted)
• 密度：
  1.550±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  13
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  68
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3-氨基-4-乙酰氨基-2,6-二氯吡啶 在 sodium hydroxide 作用下， 反应 72.0h， 生成 N-(2,6-Dichloro-4-formylamino-pyridin-3-yl)-formamide
  参考文献：
  名称：

  Design and Synthesis of a Series of Chlorinated 3-Deazaadenine Analogues

  摘要：

  A series of chlorinated adenine analogues were designed with sights set on the development of potential antitumor agents. During the synthetic efforts, two unexpected compounds were identified. Their synthesis, along with synthesis of the chlorinated targets is presented herein.

  DOI：

  10.1081/ncn-120026635
• 作为产物：
  描述：

  2,6-二氯吡啶N-氧化物 在 硫酸 、 硝酸 、 铁粉 、 溶剂黄146 作用下， 反应 2.0h， 生成 3-氨基-4-乙酰氨基-2,6-二氯吡啶
  参考文献：
  名称：

  Design and Synthesis of a Series of Chlorinated 3-Deazaadenine Analogues

  摘要：

  A series of chlorinated adenine analogues were designed with sights set on the development of potential antitumor agents. During the synthetic efforts, two unexpected compounds were identified. Their synthesis, along with synthesis of the chlorinated targets is presented herein.

  DOI：

  10.1081/ncn-120026635

文献信息

• Design and Synthesis of a Series of Chlorinated 3-Deazaadenine Analogues
  作者：Katherine L. Seley、Peter I. O'Daniel‡、Samer Salim‡

  DOI：10.1081/ncn-120026635

  日期：2003.12.31

  A series of chlorinated adenine analogues were designed with sights set on the development of potential antitumor agents. During the synthetic efforts, two unexpected compounds were identified. Their synthesis, along with synthesis of the chlorinated targets is presented herein.