9,10-dihydro-acridine-4-carboxylic acid | 40961-10-2

• 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: 9,10-dihydro-acridine-4-carboxylic acid
• 英文别名: Acridan-4-carboxylsaeure；Acridan-carbonsaeure-(4)；Acridan-4-carboxylic；9,10-dihydroacridine-4-carboxylic acid
• CAS: 40961-10-2
• 化学式: C₁₄H₁₁NO₂
• 分子量: 225.247
• InChiKey: CTNPWDBDMOFPAT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  17
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  49.3
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  9,10-dihydro-acridine-4-carboxylic acid 在 三氯化铁 作用下， 以 乙醇 为溶剂， 生成 4-吖啶羧酸
  参考文献：
  名称：

  Synthesis of C8-linked pyrrolo[2,1-c][1,4]benzodiazepine-acridone/acridine hybrids as potential DNA-binding agents

  摘要：

  Pyrrolobenzodiazepine hybrids linked to acridone/acridine ring systems at C8-position have been designed and prepared that exhibit significant DNA-binding affinity, and a representative compound shows promising in vitro anticancer activity. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.04.087
• 作为产物：
  描述：

  二苯胺-2,2’二羧酸 在 氢氧化钾 、 aluminium amalgam 、 硫酸 作用下， 以 乙醇 为溶剂， 反应 4.0h， 生成 9,10-dihydro-acridine-4-carboxylic acid
  参考文献：
  名称：

  Synthesis of C8-linked pyrrolo[2,1-c][1,4]benzodiazepine-acridone/acridine hybrids as potential DNA-binding agents

  摘要：

  Pyrrolobenzodiazepine hybrids linked to acridone/acridine ring systems at C8-position have been designed and prepared that exhibit significant DNA-binding affinity, and a representative compound shows promising in vitro anticancer activity. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.04.087

文献信息

• US7247641B2
  申请人：——

  公开号：US7247641B2

  公开（公告）日：2007-07-24
• Synthesis of C8-linked pyrrolo[2,1-c][1,4]benzodiazepine-acridone/acridine hybrids as potential DNA-binding agents
  作者：Ahmed Kamal、O Srinivas、P Ramulu、G Ramesh、P.Praveen Kumar

  DOI：10.1016/j.bmcl.2004.04.087

  日期：2004.8

  Pyrrolobenzodiazepine hybrids linked to acridone/acridine ring systems at C8-position have been designed and prepared that exhibit significant DNA-binding affinity, and a representative compound shows promising in vitro anticancer activity. (C) 2004 Elsevier Ltd. All rights reserved.