2-(dimethylamino)-6-methoxy-7,9-dimethyl-8-oxo-7,8-dihydro-9H-purine

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并嘧啶类
• 英文名称: 2-(dimethylamino)-6-methoxy-7,9-dimethyl-8-oxo-7,8-dihydro-9H-purine
• 英文别名: 2-dimethylamino-6-methoxy-7,9-dimethyl-8-purinone；heteromine J；2-(Dimethylamino)-6-methoxy-7,9-dimethylpurin-8-one
• 化学式: C₁₀H₁₅N₅O₂
• 分子量: 237.261
• InChiKey: MPGHGLUUCKNQEJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  61.8
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  2-[bis(tert-butoxycarbonyl)amino]-6-chloro-7,9-dimethyl-8-oxo-7,8-dihydro-9H-purine 在 sodium 、 三氟乙酸 、 lithium hexamethyldisilazane 作用下， 以 四氢呋喃 、 二氯甲烷 、 乙基苯 、 N,N-二甲基甲酰胺 为溶剂， 反应 34.08h， 生成 2-(dimethylamino)-6-methoxy-7,9-dimethyl-8-oxo-7,8-dihydro-9H-purine
  参考文献：
  名称：

  Regioselective and Facile Synthesis of 7,9-Dialkyl-8-oxopurines from 7,9-Dialkyl-7,8-dihydropurines: Total Synthesis of Heteromines I and J

  摘要：

  A novel protocol for the synthesis of 6-halo-8-oxo-7,8-dihydro- 9H-purines based on the oxidation of 7,9-dialkyl-7,8-dihydro-9H-purines has been developed. The presented methodology was used as a key step in the synthesis of heteromines I and J.

  DOI：

  10.1055/s-0033-1340499

文献信息

• Two New Puriniums and Three New Pyrimidines from <i>Heterostemma brownii</i>
  作者：Yun-Lian Lin、Ray-Ling Huang、Chung-Ming Chang、Yueh-Hsiung Kuo

  DOI：10.1021/np970159y

  日期：1997.10.1

  Two new puriniums, heteromines D (4) and E (5), and three new pyrimidines, heteromines F (6), G (7), and H (8), were isolated from the aerial parts of Heterostemma brownii Hay. Their structures were determined as 7,9-dimethyl-2-(N,N-dimethylamino)guaninium chloride, 7,9-dimethyl-2-(N-methylamino)guaninium chloride, 6-methoxy-4-(N-methylamino)-2-(N,N-dimethylamino)-5-(N-methylformamido)pyrimidine, 6-methoxy-2,4-bis(N-methylamino)-5-(N-methylformamido)pyrimidine, and 2-amino-6-methoxy-4-(N-methylamino)-5-(N-methylformamido)pyrimidine, respectively.
• Regioselective and Facile Synthesis of 7,9-Dialkyl-8-oxopurines from 7,9-Dialkyl-7,8-dihydropurines: Total Synthesis of Heteromines I and J
  作者：Tomáš Tobrman、Dalimil Dvořák

  DOI：10.1055/s-0033-1340499

  日期：——

  A novel protocol for the synthesis of 6-halo-8-oxo-7,8-dihydro- 9H-purines based on the oxidation of 7,9-dialkyl-7,8-dihydro-9H-purines has been developed. The presented methodology was used as a key step in the synthesis of heteromines I and J.