1-(1-(4-(9H-benzo[f]pyrido[2,3-b][1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)benzyl)piperidin-4-yl)-3-(2-(thiophen-2-yl)ethyl)urea | 1338243-02-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: 1-(1-(4-(9H-benzo[f]pyrido[2,3-b][1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)benzyl)piperidin-4-yl)-3-(2-(thiophen-2-yl)ethyl)urea
• 英文别名: 1-[1-[[4-(2,4,5,13,15-Pentazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl)phenyl]methyl]piperidin-4-yl]-3-(2-thiophen-2-ylethyl)urea
• CAS: 1338243-02-9
• 化学式: C₃₂H₃₂N₈OS
• 分子量: 576.725
• InChiKey: MWOQSYNNLOPPDD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.5
• 重原子数：
  42
• 可旋转键数：
  7
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  128
• 氢给体数：
  3
• 氢受体数：
  7

文献信息

• Substituted Benzo-Pyrido-Triazolo-Diazepine Compounds
  申请人：Ali Syed M.

  公开号：US20110245236A1

  公开（公告）日：2011-10-06

  The present invention relates to substituted benzo-pyrido-triazolo-diazepine compounds and methods of synthesizing these compounds. The present invention also relates to pharmaceutical compositions containing substituted benzo-pyrido-triazolo-diazepine compounds and methods of treating cell proliferative disorders, such as cancer, by administering these compounds or pharmaceutical compositions to subjects in need thereof.

  本发明涉及替代苯并吡啶三唑二氮杂环己烷化合物及其合成方法。本发明还涉及含有替代苯并吡啶三唑二氮杂环己烷化合物的药物组合物，以及通过向需要的受试者施用这些化合物或药物组合物来治疗细胞增殖性疾病，如癌症的方法。
• US8541407B2
  申请人：——

  公开号：US8541407B2

  公开（公告）日：2013-09-24
• [EN] SUBSTITUTED BENZO-PYRIDO-TRIAZOLO-DIAZEPINE COMPOUNDS<br/>[FR] COMPOSÉS DE BENZO-PYRIDO-TRIAZOLO-DIAZÉPINE SUBSTITUÉS
  申请人：ARQULE INC

  公开号：WO2011123678A2

  公开（公告）日：2011-10-06

  The present invention relates to substituted benzo-pyrido-triazolo-diazepine compounds and methods of synthesizing these compounds. The present invention also relates to pharmaceutical compositions containing substituted benzo-pyrido-triazolo- diazepine compounds and methods of treating cell proliferative disorders, such as cancer, by administering these compounds or pharmaceutical compositions to subjects in need thereof.