3-(4-methoxybenzyl)-2-(isopropylamino)quinazolin-4(3H)-one | 1446789-94-1

• 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: 3-(4-methoxybenzyl)-2-(isopropylamino)quinazolin-4(3H)-one
• 英文别名: 3-[(4-Methoxyphenyl)methyl]-2-(propan-2-ylamino)quinazolin-4-one；3-[(4-methoxyphenyl)methyl]-2-(propan-2-ylamino)quinazolin-4-one
• CAS: 1446789-94-1
• 化学式: C₁₉H₂₁N₃O₂
• 分子量: 323.395
• InChiKey: SGMLKOKRXULKSI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  24
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  53.9
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-amino-N-(4-methoxybenzyl)benzamide 、 N,N'-二异丙基碳二亚胺 以 neat (no solvent) 为溶剂， 反应 2.0h， 以0.25 g的产率得到3-(4-methoxybenzyl)-2-(isopropylamino)quinazolin-4(3H)-one
  参考文献：
  名称：

  Reaction of Isatoic Anhydride, Amine, and N,N′-Dialkyl Carbodiimides Under Solvent-Free Conditions: New and Efficient Synthesis of 3-Alkyl-2-(alkylamino)quinazolin-4(3H)-ones

  摘要：

  Heating a mixture of isatoic anhydride, amines, and N,N-dialkyl carbodiimides under solvent-free conditions provided novel 3-alkyl-2-(alkylamino)quinazolin-4(3H)-one derivatives for the first time. The products were obtained in moderate to good yields without formation of any by-products. Supplemental materials are available for this article. Go to the publisher's online edition of Synthetic Communications (R) to view the free supplemental file.

  DOI：

  10.1080/00397911.2012.714042

文献信息

• Reaction of Isatoic Anhydride, Amine, and <i>N,N</i>′-Dialkyl Carbodiimides Under Solvent-Free Conditions: New and Efficient Synthesis of 3-Alkyl-2-(alkylamino)quinazolin-4(3<i>H</i>)-ones
  作者：Mehdi Asadi、Mostafa Ebrahimi、Mohammad Mahdavi、Mina Saeedi、Parviz Rashidi Ranjbar、Farshad Yazdani、Abbas Shafiee、Alireza Foroumadi

  DOI：10.1080/00397911.2012.714042

  日期：2013.9.2

  Heating a mixture of isatoic anhydride, amines, and N,N-dialkyl carbodiimides under solvent-free conditions provided novel 3-alkyl-2-(alkylamino)quinazolin-4(3H)-one derivatives for the first time. The products were obtained in moderate to good yields without formation of any by-products. Supplemental materials are available for this article. Go to the publisher's online edition of Synthetic Communications (R) to view the free supplemental file.