10-(2-Hydroxyethyl)-10,20-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),3(11),4,6,8,14,16,18,20-nonaene-2,12-dione | 1388173-00-9

• 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: 10-(2-Hydroxyethyl)-10,20-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),3(11),4,6,8,14,16,18,20-nonaene-2,12-dione
• CAS: 1388173-00-9
• 化学式: C₂₁H₁₄N₂O₃
• 分子量: 342.354
• InChiKey: QSVOCHFYEQEAJV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  26
• 可旋转键数：
  2
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  72.2
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  10-(2-Hydroxyethyl)-10,20-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),3(11),4,6,8,14,16,18,20-nonaene-2,12-dione 在 间氯过氧苯甲酸 作用下， 以 二氯甲烷 为溶剂， 以61%的产率得到10-(2-Hydroxyethyl)-20-oxido-10-aza-20-azoniapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),3(11),4,6,8,14,16,18,20-nonaene-2,12-dione
  参考文献：
  名称：

  Synthesis and antimalarial activity of calothrixins A and B, and their N-alkyl derivatives

  摘要：

  We synthesized calothrixin B using our developed biomimetic method and derived N-alkyl-calothrixins A and B. The in vitro antimalarial activity of the calothrixin derivatives, including calothrixins A and B, against the Plasmodium falciparum FCR-3 strain was evaluated. All test compounds exhibited antimalarial activity over a concentration range of 6.4 x 10(-6)-1.2 x 10(-7) M. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.05.064
• 作为产物：
  描述：

  6-methoxymethyl-5-methyl-1,12-bis(methoxymethyl)indolo[2,3-a]carbazole 在 盐酸 、 ammonium cerium (IV) nitrate 、 sodium hydride 、 2,3-二氯-5,6-二氰基-1,4-苯醌 作用下， 以 四氢呋喃 、 甲醇 、 水 、 N,N-二甲基甲酰胺 为溶剂， 生成 10-(2-Hydroxyethyl)-10,20-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),3(11),4,6,8,14,16,18,20-nonaene-2,12-dione
  参考文献：
  名称：

  Synthesis and antimalarial activity of calothrixins A and B, and their N-alkyl derivatives

  摘要：

  We synthesized calothrixin B using our developed biomimetic method and derived N-alkyl-calothrixins A and B. The in vitro antimalarial activity of the calothrixin derivatives, including calothrixins A and B, against the Plasmodium falciparum FCR-3 strain was evaluated. All test compounds exhibited antimalarial activity over a concentration range of 6.4 x 10(-6)-1.2 x 10(-7) M. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.05.064

文献信息

• Synthesis and antimalarial activity of calothrixins A and B, and their N-alkyl derivatives
  作者：Kohji Matsumoto、Tominari Choshi、Mai Hourai、Yoshito Zamami、Kenji Sasaki、Takumi Abe、Minoru Ishikura、Noriyuki Hatae、Tatsunori Iwamura、Shigeo Tohyama、Junko Nobuhiro、Satoshi Hibino

  DOI：10.1016/j.bmcl.2012.05.064

  日期：2012.7

  We synthesized calothrixin B using our developed biomimetic method and derived N-alkyl-calothrixins A and B. The in vitro antimalarial activity of the calothrixin derivatives, including calothrixins A and B, against the Plasmodium falciparum FCR-3 strain was evaluated. All test compounds exhibited antimalarial activity over a concentration range of 6.4 x 10(-6)-1.2 x 10(-7) M. (C) 2012 Elsevier Ltd. All rights reserved.