2-(3-hydroxypropyl)-2-methyl-1,2,3,4-tetrahydro-4-quinazolinone | 1208003-29-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: 2-(3-hydroxypropyl)-2-methyl-1,2,3,4-tetrahydro-4-quinazolinone
• 英文别名: 2-(3-Hydroxypropyl)-2-methyl-1,3-dihydroquinazolin-4-one
• CAS: 1208003-29-5
• 化学式: C₁₂H₁₆N₂O₂
• 分子量: 220.271
• InChiKey: AXRMPQJHKJZNBI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  61.4
• 氢给体数：
  3
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-(3-hydroxypropyl)-2-methyl-1,2,3,4-tetrahydro-4-quinazolinone 在 氯化铂 作用下， 以 甲醇 为溶剂， 反应 12.0h， 以95%的产率得到3a-methyl-2,3,3a,4-tetrahydropyrrolo[1,2-a]quinazolin-5(1H)-one
  参考文献：
  名称：

  Gold- and Platinum-Catalyzed Formal Markownikoff’s Double Hydroamination of Alkynes: A Rapid Access to Tetrahydroquinazolinones and Angularly-Fused Analogues Thereof

  摘要：

  A highly efficient gold(I)- and platinum(II)-catalyzed process for formal Markownikoffs double hydroamination of alkynes tethered with hydroxyl group has been developed. The method was shown to be applicable to a broad range of 2-aminobenzamides and alkynols leading to the formation of multiply substituted tetrahydro-quinazolinones. Interestingly, when Pt(IV)Cl-4 catalyst was employed, cyclic angularly fused compound was obtained.

  DOI：

  10.1021/jo902293f
• 作为产物：
  描述：

  3-戊炔-1-醇 、 2-氨基苯甲酰胺 在 platinum(II) bromde 作用下， 以 甲醇 为溶剂， 反应 12.0h， 以92%的产率得到2-(3-hydroxypropyl)-2-methyl-1,2,3,4-tetrahydro-4-quinazolinone
  参考文献：
  名称：

  Gold- and Platinum-Catalyzed Formal Markownikoff’s Double Hydroamination of Alkynes: A Rapid Access to Tetrahydroquinazolinones and Angularly-Fused Analogues Thereof

  摘要：

  A highly efficient gold(I)- and platinum(II)-catalyzed process for formal Markownikoffs double hydroamination of alkynes tethered with hydroxyl group has been developed. The method was shown to be applicable to a broad range of 2-aminobenzamides and alkynols leading to the formation of multiply substituted tetrahydro-quinazolinones. Interestingly, when Pt(IV)Cl-4 catalyst was employed, cyclic angularly fused compound was obtained.

  DOI：

  10.1021/jo902293f

文献信息

• Gold- and Platinum-Catalyzed Formal Markownikoff’s Double Hydroamination of Alkynes: A Rapid Access to Tetrahydroquinazolinones and Angularly-Fused Analogues Thereof
  作者：Nitin T. Patil、Rahul D. Kavthe、Vivek S. Raut、Valmik S. Shinde、Balasubramanian Sridhar

  DOI：10.1021/jo902293f

  日期：2010.2.19

  A highly efficient gold(I)- and platinum(II)-catalyzed process for formal Markownikoffs double hydroamination of alkynes tethered with hydroxyl group has been developed. The method was shown to be applicable to a broad range of 2-aminobenzamides and alkynols leading to the formation of multiply substituted tetrahydro-quinazolinones. Interestingly, when Pt(IV)Cl-4 catalyst was employed, cyclic angularly fused compound was obtained.