methyl 2-(3-allyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetate | 84703-24-2

• 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: methyl 2-(3-allyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetate
• 英文别名: methyl 2-(4-oxo-3-prop-2-enylphthalazin-1-yl)acetate
• CAS: 84703-24-2
• 化学式: C₁₄H₁₄N₂O₃
• 分子量: 258.277
• InChiKey: KWFQMYGXGZAHSA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  19.0
• 可旋转键数：
  4.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  61.19
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  methyl 2-(3-allyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetate 在 N-氯代丁二酰亚胺 、 sodium hydride 、 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 、 paraffin oil 为溶剂， 反应 19.5h， 生成 methyl 3-methoxy-2-(3-((3-methyl-4,5-dihydroisoxazol-5-yl)methyl)-4-oxo-3,4-dihydrophthalazin-1-yl)acrylate
  参考文献：
  名称：

  Synthesis, antimicrobial and cytotoxicity studies of some novel modified Strobilurin derivatives

  摘要：

  A series of some new 3-isoxazoline substituted methyl-3-methoxy-2-(4-oxo-3,4-dihydrophthalazin-1-yl)prop-2-enoate derivatives were designed and synthesized from methyl-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate, which in turn was prepared from phthalic anhydride. The structures of synthesized new compounds were characterized by spectral data and studied for their antimicrobial activities and cytotoxicity. Several of these compounds showed good antimicrobial activity.

  DOI：

  10.1590/s0103-50532011000500006
• 作为产物：
  描述：

  2-(4-氧-3,4-二氢邻苯二甲秦)乙酸 在 硫酸 、 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 6.0h， 生成 methyl 2-(3-allyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetate
  参考文献：
  名称：

  Synthesis, antimicrobial and cytotoxicity studies of some novel modified Strobilurin derivatives

  摘要：

  A series of some new 3-isoxazoline substituted methyl-3-methoxy-2-(4-oxo-3,4-dihydrophthalazin-1-yl)prop-2-enoate derivatives were designed and synthesized from methyl-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate, which in turn was prepared from phthalic anhydride. The structures of synthesized new compounds were characterized by spectral data and studied for their antimicrobial activities and cytotoxicity. Several of these compounds showed good antimicrobial activity.

  DOI：

  10.1590/s0103-50532011000500006

文献信息

• Synthesis and Antimicrobial Studies of Some New 3-Isoxazoline Substituted Phthalazine Methylsulfonyl Oxadiazoles
  作者：A. M. Sridhara、K. R. Venugopala Reddy、J. Keshavayya、D. S. Ambika、Sanathkumar Goud、S. K. Peethambar

  DOI：10.1155/2011/356437

  日期：——

  A series of new 3-isoxazoline substituted phthalazine methylsulfonyl-oxadiazoles were prepared from methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl) acetate. The structure of synthesized compounds were characterized by spectral data and screened for their antimicrobial activities against various bacteria and fungi strains. Several of these compounds showed antimicrobial activity.

  一系列新的3-异噁唑烷基苯并噻唑甲磺基-噁唑酮从甲基2-(4-氧代-3,4-二氢苯并噻唑-1-基)乙酸酯制备而成。合成化合物的结构通过光谱数据进行表征，并对其抗菌活性进行筛选，针对不同的细菌和真菌菌株。其中几种化合物显示出抗菌活性。
• SHATALOV, G. V.;GRIDCHIN, S. A.;KOVALEV, G. V.;MIXANTEV, B. I.;GOFMAN, S.+, IZV. VUZOV. XIMIYA I XIM. TEXNOL., 1982, 25, N 10, 1179-1184
  作者：SHATALOV, G. V.、GRIDCHIN, S. A.、KOVALEV, G. V.、MIXANTEV, B. I.、GOFMAN, S.+

  DOI：——

  日期：——