5-[1-(2-fluoro-phenyl)-1-methyl-ethylcarbamoyl]-3-{4-(4-methyl-piperazin-1-yl)-2-[(tetrahydro-pyran-4-carbonyl)-amino]-benzoylamino}-thieno[2,3-c]pyrazole-1-carboxylic acid ethyl ester | 921768-44-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 5-[1-(2-fluoro-phenyl)-1-methyl-ethylcarbamoyl]-3-{4-(4-methyl-piperazin-1-yl)-2-[(tetrahydro-pyran-4-carbonyl)-amino]-benzoylamino}-thieno[2,3-c]pyrazole-1-carboxylic acid ethyl ester
• 英文别名: Ethyl 5-[2-(2-fluorophenyl)propan-2-ylcarbamoyl]-3-[[4-(4-methylpiperazin-1-yl)-2-(oxane-4-carbonylamino)benzoyl]amino]thieno[2,3-c]pyrazole-1-carboxylate
• CAS: 921768-44-7
• 化学式: C₃₆H₄₂FN₇O₆S
• 分子量: 719.837
• InChiKey: ZCAYOTQADUTLSH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  51
• 可旋转键数：
  10
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  175
• 氢给体数：
  3
• 氢受体数：
  11

文献信息

• 1H-Thieno[2,3-c]Pyrazole Compounds Useful as Kinase Inhibitors
  申请人：Fancelli Daniele

  公开号：US20090149457A1

  公开（公告）日：2009-06-11

  There are provided thieno[2,3-c]pyrazole derivatives of formula (I), wherein A is an aryl or heteroaryl ring, on which the substituent-NHZR 5 is at the ortho position to the CONH linker; R 1 and R 2 are the same or different and, independently from each other, represent a hydrogen atom or an organic group; R 4 is a hydrogen or halogen atom or an organic group; Z is direct bond, >C═O, or —C(═O)NH—; R 5 is hydrogen or an organic group; or isomers, tautomers, carriers, metabolites, prodrugs, and pharamaceutically acceptable salts thereof. A process for their preparation and pharamaceutical compositions comprising them are also disclosed; the compounds of the invention may be useful, in theraphy, in the treatment of diseases associated with a disregulated protein kinase activity, like cancer.

  提供了式(I)的噻吩[2,3-c]吡唑衍生物，其中A是芳基或杂环芳基环，其上取代基-NHZR5位于CONH连接基的邻位；R1和R2相同或不同且独立地表示氢原子或有机基团；R4是氢原子或卤素原子或有机基团；Z是直接键，>C═O或—C(═O)NH—；R5是氢原子或有机基团；或其异构体，互变异构体，载体，代谢产物，前药和药物学上可接受的盐。还公开了它们的制备方法和包含它们的药物组合物；该发明的化合物在治疗与蛋白激酶活性失调相关的疾病，如癌症方面可能有用。
• 1H-THIENO[2,3-C]-PYRAZOLE COMPOUNDS USEFUL AS KINASE INHIBITORS
  申请人：NERVIANO MEDICAL SCIENCES S.R.L.

  公开号：EP1904503B1

  公开（公告）日：2013-11-06
• US7943654B2
  申请人：——

  公开号：US7943654B2

  公开（公告）日：2011-05-17