(2,4-dinitrophenoxy)imino-[(2-methylpropan-2-yl)oxycarbonyl-propan-2-ylamino]-oxidoazanium | 1370046-89-1

• 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: (2,4-dinitrophenoxy)imino-[(2-methylpropan-2-yl)oxycarbonyl-propan-2-ylamino]-oxidoazanium
• CAS: 1370046-89-1
• 化学式: C₁₄H₁₉N₅O₈
• 分子量: 385.334
• InChiKey: JSMORBHFGATHII-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.32
• 重原子数：
  27.0
• 可旋转键数：
  6.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  163.48
• 氢给体数：
  0.0
• 氢受体数：
  9.0

反应信息

• 作为反应物：
  描述：

  (2,4-dinitrophenoxy)imino-[(2-methylpropan-2-yl)oxycarbonyl-propan-2-ylamino]-oxidoazanium 在 谷胱甘肽 、 二乙烯三胺五醋酸 作用下， 以 二甲基亚砜 为溶剂， 反应 6.67h， 生成 N-BOC-异丙胺
  参考文献：
  名称：

  Diazeniumdiolated carbamates: A novel class of nitric oxide donors

  摘要：

  We report an indirect method for synthesis of previously inaccessible diazeniumdiolated carbamates. Synthesis involves use of previously reported triisopropylsilyloxymethylated isopropylamine diazeniumdiolate (TOM-ylated IPA/NO). These novel diazeniumdiolated carbamate prodrugs upon activation release nitric oxide (NO) similar to their secondary amine counterparts. They are also efficient sources of intracellular NO. These prodrugs may have potential applications as therapeutic NO-donors. (C) 2012 Elsevier Ltd. All rights

  DOI：

  10.1016/j.bmc.2012.01.046
• 作为产物：
  描述：

  二碳酸二叔丁酯 在 四丁基氟化铵 、 lithium tert-butoxide 作用下， 以 正己烷 、 二氯甲烷 为溶剂， 反应 2.66h， 生成 (2,4-dinitrophenoxy)imino-[(2-methylpropan-2-yl)oxycarbonyl-propan-2-ylamino]-oxidoazanium
  参考文献：
  名称：

  Diazeniumdiolated carbamates: A novel class of nitric oxide donors

  摘要：

  We report an indirect method for synthesis of previously inaccessible diazeniumdiolated carbamates. Synthesis involves use of previously reported triisopropylsilyloxymethylated isopropylamine diazeniumdiolate (TOM-ylated IPA/NO). These novel diazeniumdiolated carbamate prodrugs upon activation release nitric oxide (NO) similar to their secondary amine counterparts. They are also efficient sources of intracellular NO. These prodrugs may have potential applications as therapeutic NO-donors. (C) 2012 Elsevier Ltd. All rights

  DOI：

  10.1016/j.bmc.2012.01.046

文献信息

• Diazeniumdiolated carbamates: A novel class of nitric oxide donors
  作者：Rahul S. Nandurdikar、Anna E. Maciag、Zhao Cao、Larry K. Keefer、Joseph E. Saavedra

  DOI：10.1016/j.bmc.2012.01.046

  日期：2012.3

  We report an indirect method for synthesis of previously inaccessible diazeniumdiolated carbamates. Synthesis involves use of previously reported triisopropylsilyloxymethylated isopropylamine diazeniumdiolate (TOM-ylated IPA/NO). These novel diazeniumdiolated carbamate prodrugs upon activation release nitric oxide (NO) similar to their secondary amine counterparts. They are also efficient sources of intracellular NO. These prodrugs may have potential applications as therapeutic NO-donors. (C) 2012 Elsevier Ltd. All rights