ethyl 4-(4-((4-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)pyrimidin-2-ylamino)methyl)piperidine-1-carboxamido)benzoate | 1312995-45-1

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: ethyl 4-(4-((4-(5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl)pyrimidin-2-ylamino)methyl)piperidine-1-carboxamido)benzoate
• 英文别名: Ethyl 4-[[4-[[[4-(1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-3-yl)pyrimidin-2-yl]amino]methyl]piperidine-1-carbonyl]amino]benzoate
• CAS: 1312995-45-1
• 化学式: C₃₁H₃₄N₆O₃
• 分子量: 538.649
• InChiKey: SSPWHCWSTATULL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  40
• 可旋转键数：
  8
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  101
• 氢给体数：
  2
• 氢受体数：
  6

文献信息

• Substituted Heterocyclic Compounds
  申请人：Ali Syed M.

  公开号：US20110160237A1

  公开（公告）日：2011-06-30

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

  本发明涉及替代杂环化合物及其合成方法。本发明还涉及含有替代杂环化合物的药物组合物以及通过向需要的受试者投与这些化合物和药物组合物来治疗细胞增殖性疾病，如癌症的方法。
• US8563567B2
  申请人：——

  公开号：US8563567B2

  公开（公告）日：2013-10-22
• [EN] SUBSTITUTED HETEROCYCLIC COMPOUNDS<br/>[FR] COMPOSÉS HÉTÉROCYCLIQUES SUBSTITUÉS
  申请人：ARQULE INC

  公开号：WO2011082266A2

  公开（公告）日：2011-07-07

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