N-[2-(2,2-Dimethoxy-ethyl)-[1,3]dioxan-5-yl]-2-phenyl-acetamide | 866612-72-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: N-[2-(2,2-Dimethoxy-ethyl)-[1,3]dioxan-5-yl]-2-phenyl-acetamide
• CAS: 866612-72-8
• 化学式: C₁₆H₂₃NO₅
• 分子量: 309.362
• InChiKey: PQCOKAGVMHPANT-AKAXFMLLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  22.0
• 可旋转键数：
  7.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  66.02
• 氢给体数：
  1.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  N-[2-(2,2-Dimethoxy-ethyl)-[1,3]dioxan-5-yl]-2-phenyl-acetamide 在 草酸 、 silica gel 、 三氟乙酸 作用下， 以 氯仿 为溶剂， 反应 40.0h， 生成 (cis)-[N-2-(1,3-dioxolan-2-yl)methyl-1,3-dioxan-5-yl]phenylacetamide
  参考文献：
  名称：

  Novel synthesis and anti-inflammatory activities of 2,5-disubstituted-dioxacycloalkanes

  摘要：

  A novel stereospecific synthetic route to obtain a series of 2,5-disubstituted-dioxacycloalkanes is reported. Using an in vivo inhibition assay by monitoring xylene-induced ear edema in mice, the structure-activity relationship of the dioxacycloalkane compounds was studied, and compounds possessing high anti-inflammatory activity were identified. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2005.05.032
• 作为产物：
  描述：

  1,1,3,3-四甲氧基丙烷 在 磷酸 、 四溴环己二烯-1-酮 、 原甲酸三乙酯 作用下， 以 乙腈 为溶剂， 反应 40.0h， 生成 N-[2-(2,2-Dimethoxy-ethyl)-[1,3]dioxan-5-yl]-2-phenyl-acetamide
  参考文献：
  名称：

  Novel synthesis and anti-inflammatory activities of 2,5-disubstituted-dioxacycloalkanes

  摘要：

  A novel stereospecific synthetic route to obtain a series of 2,5-disubstituted-dioxacycloalkanes is reported. Using an in vivo inhibition assay by monitoring xylene-induced ear edema in mice, the structure-activity relationship of the dioxacycloalkane compounds was studied, and compounds possessing high anti-inflammatory activity were identified. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2005.05.032