2-Oxo-7-sulfamoyl-2,3,4,5-tetrahydro-3-carbolin | 7041-63-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: 2-Oxo-7-sulfamoyl-2,3,4,5-tetrahydro-3-carbolin
• 英文别名: 1-oxo-2,3,4,9-tetrahydro-1H-β-carboline-6-sulfonic acid amide；1-Oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-6-sulfonamide
• CAS: 7041-63-6
• 化学式: C₁₁H₁₁N₃O₃S
• 分子量: 265.293
• InChiKey: KEAMZULJOUOGHV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  18
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  113
• 氢给体数：
  3
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  邻氨基苯甲酸 、 2-Oxo-7-sulfamoyl-2,3,4,5-tetrahydro-3-carbolin 在 三氯氧磷 作用下， 以 甲苯 为溶剂， 反应 1.0h， 生成 5-Oxo-5,7,8,13,13b,14-hexahydro-indolo[2',3':3,4]pyrido[2,1-b]quinazoline-10-sulfonic acid amide
  参考文献：
  名称：

  Synthesis and cytotoxic activity of novel quinazolino-β-carboline-5-one derivatives

  摘要：

  A novel series of quinazolino-beta-carbolinone derivatives was synthesized and evaluated for their in vitro and in vivo anticancer activity. Many compounds have shown good in vitro activity in the range 1-8 muM concentration. Three of the compounds were further tested in nude mice bearing HT-29 colon cancer xenografts. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2004.03.005
• 作为产物：
  描述：

  Piperidin-2,3-dion-3-(4-sulfamoyl-phenylhydrazon) 在 甲酸 作用下， 反应 1.0h， 生成 2-Oxo-7-sulfamoyl-2,3,4,5-tetrahydro-3-carbolin
  参考文献：
  名称：

  Synthesis and cytotoxic activity of novel quinazolino-β-carboline-5-one derivatives

  摘要：

  A novel series of quinazolino-beta-carbolinone derivatives was synthesized and evaluated for their in vitro and in vivo anticancer activity. Many compounds have shown good in vitro activity in the range 1-8 muM concentration. Three of the compounds were further tested in nude mice bearing HT-29 colon cancer xenografts. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2004.03.005