tert-butyl N-[4-(9-acridinylamino)butyl]carbamate | 92143-59-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: tert-butyl N-[4-(9-acridinylamino)butyl]carbamate
• 英文别名: 9-<4-(Boc-amino)butyl>acridine；tert-butyl N-[4-(acridin-9-ylamino)butyl]carbamate
• CAS: 92143-59-4
• 化学式: C₂₂H₂₇N₃O₂
• 分子量: 365.475
• InChiKey: JPIUWGUZEPGOIJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  27
• 可旋转键数：
  8
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  63.2
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  tert-butyl N-[4-(9-acridinylamino)butyl]carbamate 在 N-甲基吗啉 、 盐酸 、 氯甲酸异丁酯 作用下， 以 甲醇 、 水 、 乙酸乙酯 、 N,N-二甲基甲酰胺 为溶剂， 反应 35.0h， 生成 ethyl 2-((2-{[4-(9-acridinylamino)butyl]amino}-2-oxoethyl){2-[di-(2-ethoxy-2-oxoethyl)amino]ethyl}amino) acetate
  参考文献：
  名称：

  Synthesis of pathogen inactivating nucleic acid intercalators

  摘要：

  A series of antiviral compounds consisting of an intercalating acridine derived part, a spacer region and a reactive EDTA-derived conjugate was synthesized in an easy sequence starting from 1,omega-alkyldiamines. As shown in model screenings, in the presence of ascorbic acid the Fe-complexes of these compounds reduced the phage-titer of MS2-phages by several logarithmic decades. (C) 2004 Elsevier SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2004.07.011
• 作为产物：
  描述：

  9-氯吖啶 、 N-叔丁氧羰基-1,4-丁二胺 在 苯酚 作用下， 反应 1.0h， 以84%的产率得到tert-butyl N-[4-(9-acridinylamino)butyl]carbamate
  参考文献：
  名称：

  Synthesis of pathogen inactivating nucleic acid intercalators

  摘要：

  A series of antiviral compounds consisting of an intercalating acridine derived part, a spacer region and a reactive EDTA-derived conjugate was synthesized in an easy sequence starting from 1,omega-alkyldiamines. As shown in model screenings, in the presence of ascorbic acid the Fe-complexes of these compounds reduced the phage-titer of MS2-phages by several logarithmic decades. (C) 2004 Elsevier SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2004.07.011

文献信息

• Designing photoaffinity labeling reagents for chromatin studies
  作者：Ole Buchardt、Ulrich Ehrbar、Charles Larsen、Joergen Moeller、Peter E. Nielsen、Tove Thomsen、Frank Waetjen、John Bondo Hansen

  DOI：10.1021/jo00196a004

  日期：1984.11
• BUCHARD, O.;EHRBAR, U.;LARSEN, CH.;MOLLER, J.;NIELSEN, P. E.;THOMSEN, T.;+, J. ORG. CHEM., 1984, 49, N 22, 4123-4127
  作者：BUCHARD, O.、EHRBAR, U.、LARSEN, CH.、MOLLER, J.、NIELSEN, P. E.、THOMSEN, T.、+

  DOI：——

  日期：——
• Synthesis of pathogen inactivating nucleic acid intercalators
  作者：René Csuk、Alexander Barthel、Thorsten Brezesinski、Christian Raschke

  DOI：10.1016/j.ejmech.2004.07.011

  日期：2004.11

  A series of antiviral compounds consisting of an intercalating acridine derived part, a spacer region and a reactive EDTA-derived conjugate was synthesized in an easy sequence starting from 1,omega-alkyldiamines. As shown in model screenings, in the presence of ascorbic acid the Fe-complexes of these compounds reduced the phage-titer of MS2-phages by several logarithmic decades. (C) 2004 Elsevier SAS. All rights reserved.