tert-butyl N-[3-[2-(diethylamino)ethyl-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]amino]propyl]carbamate | 133236-87-0

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: tert-butyl N-[3-[2-(diethylamino)ethyl-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]amino]propyl]carbamate
• CAS: 133236-87-0
• 化学式: C₂₂H₄₆N₄O₄
• 分子量: 430.632
• InChiKey: JGZZPIZCPRRGMN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  30
• 可旋转键数：
  17
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.91
• 拓扑面积：
  83.1
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  tert-butyl N-[3-[2-(diethylamino)ethyl-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]amino]propyl]carbamate 在 盐酸 作用下， 以 乙醇 为溶剂， 以7 g的产率得到N³-<2,2-(diethylamino)ethyl>-N³-(3-aminopropyl)-1,3-diaminopropane tetrahydrochloride
  参考文献：
  名称：

  Synthesis and antibacterial activity of a series of basic amides of teicoplanin and deglucoteicoplanin with polyamines

  摘要：

  Basic carboxamides of teicoplanin A2 (CTA) and its aglycon (TD) are prepared by condensation of the 63-carboxyl function of these antibiotics with linear or branched polyamines. The antimicrobial activities of some of the resulting compounds were better than those of the unmodified antibiotics. The presence of more than one basic group in the amidic chain enhanced the in vitro activity of some TD-amides against Gram-negative bacteria; two of these derivatives were also effective in vivo against Escherichia coli septicemia in the mouse. Among the CTA derivatives, the amide with spermine showed some unexpected in vitro activity against Gram-negatives. Both CTA- and TD-amides with polyamines are very soluble in water over a wide range of pH and are very hydrophilic.

  DOI：

  10.1021/jm00100a010
• 作为产物：
  描述：

  3,3'-二氨基二丙基胺 在 potassium carbonate 、 potassium iodide 作用下， 以 四氢呋喃 为溶剂， 反应 17.0h， 生成 tert-butyl N-[3-[2-(diethylamino)ethyl-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]amino]propyl]carbamate
  参考文献：
  名称：

  Synthesis and antibacterial activity of a series of basic amides of teicoplanin and deglucoteicoplanin with polyamines

  摘要：

  Basic carboxamides of teicoplanin A2 (CTA) and its aglycon (TD) are prepared by condensation of the 63-carboxyl function of these antibiotics with linear or branched polyamines. The antimicrobial activities of some of the resulting compounds were better than those of the unmodified antibiotics. The presence of more than one basic group in the amidic chain enhanced the in vitro activity of some TD-amides against Gram-negative bacteria; two of these derivatives were also effective in vivo against Escherichia coli septicemia in the mouse. Among the CTA derivatives, the amide with spermine showed some unexpected in vitro activity against Gram-negatives. Both CTA- and TD-amides with polyamines are very soluble in water over a wide range of pH and are very hydrophilic.

  DOI：

  10.1021/jm00100a010

文献信息

• Synthesis and antibacterial activity of a series of basic amides of teicoplanin and deglucoteicoplanin with polyamines
  作者：Adriano Malabarba、Romeo Ciabatti、Jurgen Kettenring、Roberto Scotti、Gianpaolo Candiani、Rosa Pallanza、Marisa Berti、Beth P. Goldstein

  DOI：10.1021/jm00100a010

  日期：1992.10

  Basic carboxamides of teicoplanin A2 (CTA) and its aglycon (TD) are prepared by condensation of the 63-carboxyl function of these antibiotics with linear or branched polyamines. The antimicrobial activities of some of the resulting compounds were better than those of the unmodified antibiotics. The presence of more than one basic group in the amidic chain enhanced the in vitro activity of some TD-amides against Gram-negative bacteria; two of these derivatives were also effective in vivo against Escherichia coli septicemia in the mouse. Among the CTA derivatives, the amide with spermine showed some unexpected in vitro activity against Gram-negatives. Both CTA- and TD-amides with polyamines are very soluble in water over a wide range of pH and are very hydrophilic.