N-<3,4-dimethoxyphenyl(thioacetyl)>morpholine | 83814-21-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: N-<3,4-dimethoxyphenyl(thioacetyl)>morpholine
• 英文别名: 2-(3,4-dimethoxyphenyl)-1-(morpholin-4-yl)ethanethione；4-[(3,4-dimethoxy-phenyl)-thioacetyl]-morpholine；4-[(3,4-Dimethoxy-phenyl)-thioacetyl]-morpholin；2-(3,4-Dimethoxy-phenyl)-1-morpholin-4-yl-ethanethione；2-(3,4-dimethoxyphenyl)-1-morpholin-4-ylethanethione
• CAS: 83814-21-5
• 化学式: C₁₄H₁₉NO₃S
• 分子量: 281.376
• InChiKey: FLGFDYWUCULTLM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  63
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N-<3,4-dimethoxyphenyl(thioacetyl)>morpholine 在 氢氧化钾 作用下， 生成 3,4-二甲氧基苯乙酸
  参考文献：
  名称：

  Arylcycloalkylamines. III. 2-(3,4-Dimethoxyphenyl)-cyclopropylamine¹

  摘要：

  DOI：

  10.1021/ja01133a505
• 作为产物：
  描述：

  吗啉 、 3,4-二甲氧基苯乙酮 在 sulfur 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 5.0h， 以18%的产率得到N-<3,4-dimethoxyphenyl(thioacetyl)>morpholine
  参考文献：
  名称：

  Liepa, Andris J., Australian Journal of Chemistry, 1982, vol. 35, # 7, p. 1391 - 1403

  摘要：

  DOI：

文献信息

• Liepa, Andris J., Australian Journal of Chemistry, 1982, vol. 35, # 7, p. 1391 - 1403
  作者：Liepa, Andris J.

  DOI：——

  日期：——
• Phansalkar, Mahesh S.; Deshmukh, Keshav K.; Kelkar, Shriniwas L., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1987, vol. 26, # 1-12, p. 562 - 563
  作者：Phansalkar, Mahesh S.、Deshmukh, Keshav K.、Kelkar, Shriniwas L.、Wadia, Murzban S.

  DOI：——

  日期：——
• LIEPA, A. J., AUSTRAL. J. CHEM., 1982, 35, N 7, 1391-1403
  作者：LIEPA, A. J.

  DOI：——

  日期：——
• PHANSALKAR, MAHESH S.;DESHMUKH, KESHAV K.;KELKAR, SHRINIWAS L.;WADIA, MUR+, INDIAN J. CHEM., 26,(1987) N 6, 562-563
  作者：PHANSALKAR, MAHESH S.、DESHMUKH, KESHAV K.、KELKAR, SHRINIWAS L.、WADIA, MUR+

  DOI：——

  日期：——
• Silica-supported fluoroboric acid (HBF4–SiO2) catalyzed highly productive synthesis of thiomorpholides as activators of l-asparaginase as well as the antioxidant agent
  作者：Babasaheb P. Bandgar、Shrikant S. Gawande、Suchita C. Warangkar、Jalinder V. Totre

  DOI：10.1016/j.bmc.2010.03.033

  日期：2010.5

  An efficient solvent-free procedure for the synthesis of thiomorpholides in the presence of a catalytic amount of solid-supported fluoroboric acid (HBF4-SiO2) is described. The advantages of this method are high yields, short reaction times, ease of product isolation, low cost, and the catalyst can be recycled for a number of times without significant loss of activity. Three thiomorpholides possessing electron-donating group (4c, 4g, and 4h) were exhibiting excellent stimulatory activities against Erwinia carotovora L-asparaginase. The most potent activator, compound 4h displayed the following kinetic parameters, K-m = 75 mu M and V-max = 1000 mu mol mg(-1) min(-1) and K-A = 0.985 mu M. Furthermore, these compounds (4g, 4h, 4c, 4f, 4a, and 4d) have also shown promising 2,2'-diphenyl-1-picrylhydrazyl (DPPH) reducing antioxidant activity (21-36%) at 1 mM concentration as compared to standard butylated hydroxyl anisole (72% at 1 mM). (C) 2010 Published by Elsevier Ltd.