benzoic acid 2-tert-butoxycarbonylamino-1-(tert-butoxycarbonylaminomethyl)ethyl ester | 1122410-51-8

• 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: benzoic acid 2-tert-butoxycarbonylamino-1-(tert-butoxycarbonylaminomethyl)ethyl ester
• 英文别名: 1,3-Bis[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl benzoate
• CAS: 1122410-51-8
• 化学式: C₂₀H₃₀N₂O₆
• 分子量: 394.468
• InChiKey: GLYDBHROOPQQEY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  28
• 可旋转键数：
  11
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  103
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  benzoic acid 2-tert-butoxycarbonylamino-1-(tert-butoxycarbonylaminomethyl)ethyl ester 在 盐酸 、 水 作用下， 以 四氢呋喃 为溶剂， 反应 4.0h， 生成
  参考文献：
  名称：

  2-[2-Substituted-3-(3,4-dichlorobenzylamino)propylamino]-1H-quinolin-4-ones as Staphylococcus aureus methionyl-tRNA synthetase inhibitors

  摘要：

  New analogues of 2-[2-substituted-3-(3,4-dichlorobenzylamino)propylamino]quinolin-4-ones, 26a, 26b, 31a-e, 34, 35, 38 and 40, have been synthesized and evaluated against Staphylococcus aureus methionyl-tRNA synthetase. All of the synthesized compounds were less active than the reference compound 2. The compounds were also screened against various strains of S. aureus and Enterococci for their antibacterial activities. Among the compounds, 26b, 31c and 31e displayed significant inhibitory properties against various strains of Enterococci compared to compound 2. (C) 2008 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2008.02.021
• 作为产物：
  描述：

  苯甲酰氯 、 1,3-二-(Boc-氨基)-2-羟基丙烷 在 吡啶 作用下， 以 二氯甲烷 为溶剂， 反应 6.0h， 以70%的产率得到benzoic acid 2-tert-butoxycarbonylamino-1-(tert-butoxycarbonylaminomethyl)ethyl ester
  参考文献：
  名称：

  2-[2-Substituted-3-(3,4-dichlorobenzylamino)propylamino]-1H-quinolin-4-ones as Staphylococcus aureus methionyl-tRNA synthetase inhibitors

  摘要：

  New analogues of 2-[2-substituted-3-(3,4-dichlorobenzylamino)propylamino]quinolin-4-ones, 26a, 26b, 31a-e, 34, 35, 38 and 40, have been synthesized and evaluated against Staphylococcus aureus methionyl-tRNA synthetase. All of the synthesized compounds were less active than the reference compound 2. The compounds were also screened against various strains of S. aureus and Enterococci for their antibacterial activities. Among the compounds, 26b, 31c and 31e displayed significant inhibitory properties against various strains of Enterococci compared to compound 2. (C) 2008 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2008.02.021

文献信息

• 2-[2-Substituted-3-(3,4-dichlorobenzylamino)propylamino]-1H-quinolin-4-ones as Staphylococcus aureus methionyl-tRNA synthetase inhibitors
  作者：Farhanullah、Taehee Kang、Eun-Jung Yoon、Eun-Chil Choi、Sunghoon Kim、Jeewoo Lee

  DOI：10.1016/j.ejmech.2008.02.021

  日期：2009.1

  New analogues of 2-[2-substituted-3-(3,4-dichlorobenzylamino)propylamino]quinolin-4-ones, 26a, 26b, 31a-e, 34, 35, 38 and 40, have been synthesized and evaluated against Staphylococcus aureus methionyl-tRNA synthetase. All of the synthesized compounds were less active than the reference compound 2. The compounds were also screened against various strains of S. aureus and Enterococci for their antibacterial activities. Among the compounds, 26b, 31c and 31e displayed significant inhibitory properties against various strains of Enterococci compared to compound 2. (C) 2008 Elsevier Masson SAS. All rights reserved.