methyl 2-[(2S,6R)-2-[[chloro-(dimethylamino)-oxidophosphaniumyl]oxymethyl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-4-yl]-3-phenylpropanoate | 1414959-72-0

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: methyl 2-[(2S,6R)-2-[[chloro-(dimethylamino)-oxidophosphaniumyl]oxymethyl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-4-yl]-3-phenylpropanoate
• CAS: 1414959-72-0
• 化学式: C₂₂H₃₀ClN₄O₇P
• 分子量: 528.93
• InChiKey: QVKWXOUIQFJHJE-XIKYPSIFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  35
• 可旋转键数：
  10
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  124
• 氢给体数：
  1
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  、 N,N-二甲基磷氨基二氯化物 在 1,8-二氮杂双环[5.4.0]十一碳-7-烯 、 lithium bromide 作用下， 以 二氯甲烷 、 乙腈 为溶剂， 反应 0.7h， 以51%的产率得到methyl 2-[(2S,6R)-2-[[chloro-(dimethylamino)-oxidophosphaniumyl]oxymethyl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-4-yl]-3-phenylpropanoate
  参考文献：
  名称：

  Lithium bromide–DBU mediated synthesis of chlorophosphoramidate-activated morpholino nucleoside subunits

  摘要：

  An efficient and rapid protocol for the synthesis of chlorophosphoramidate-activated morpholino sub-units has been developed. A unique combination of lithium bromide-DBU has been found to activate the 7'-hydroxyl toward the reaction. All the four morpholino units of adenosine, guanosine, cytosine, and thymine responded smoothly to the developed protocol. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.09.126

文献信息

• Lithium bromide–DBU mediated synthesis of chlorophosphoramidate-activated morpholino nucleoside subunits
  作者：Sankha Pattanayak、Surajit Sinha

  DOI：10.1016/j.tetlet.2012.09.126

  日期：2012.12

  An efficient and rapid protocol for the synthesis of chlorophosphoramidate-activated morpholino sub-units has been developed. A unique combination of lithium bromide-DBU has been found to activate the 7'-hydroxyl toward the reaction. All the four morpholino units of adenosine, guanosine, cytosine, and thymine responded smoothly to the developed protocol. (C) 2012 Elsevier Ltd. All rights reserved.