2-[(1S)-1-({[2-(methoxycarbonyl)-3-thienyl]sulfonyl}amino)-7-oxooctyl]-5-phenyl-1H-imidazol-3-ium trifluoroacetate | 891260-21-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-[(1S)-1-({[2-(methoxycarbonyl)-3-thienyl]sulfonyl}amino)-7-oxooctyl]-5-phenyl-1H-imidazol-3-ium trifluoroacetate
• 英文别名: methyl 3-[[(1S)-7-oxo-1-(5-phenyl-1H-imidazol-2-yl)octyl]sulfamoyl]thiophene-2-carboxylate;2,2,2-trifluoroacetic acid
• CAS: 891260-21-2
• 化学式: C₂HF₃O₂*C₂₃H₂₇N₃O₅S₂
• 分子量: 603.64
• InChiKey: OURYQRSCFFPBBG-FERBBOLQSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.12
• 重原子数：
  40
• 可旋转键数：
  13
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  196
• 氢给体数：
  3
• 氢受体数：
  12

文献信息

• Heterocycle Derivatives As Histone Deacetylase (Hdac) Inhibitors
  申请人：Attenni Barbara

  公开号：US20090048228A1

  公开（公告）日：2009-02-19

  The present invention relates to compounds of formula I: or pharmaceutically acceptable salts or tautomers thereof, which are inhibitors of histone deacetylase (HDAC). The compounds of the present invention are useful for treating cellular proliferative diseases, including cancer. Further, the compounds of the present invention are useful for treating neurodegenerative diseases, schizophrenia and stroke among other diseases.

  本发明涉及以下式I的化合物：或其药用可接受的盐或互变异构体，这些化合物是组蛋白去乙酰化酶（HDAC）的抑制剂。本发明的化合物可用于治疗细胞增殖性疾病，包括癌症。此外，本发明的化合物还可用于治疗神经退行性疾病、精神分裂症和中风等其他疾病。
• PI-ELECTRON CONJUGATED BLOCK COPOLYMER AND PHOTOELECTRIC CONVERSION ELEMENT
  申请人：Inagaki Takuya

  公开号：US20140084220A1

  公开（公告）日：2014-03-27

  Provided is a conjugated block copolymer that is capable of morphology control and that can achieve superior conversion efficiency. A π-electron conjugated block copolymer contiguously or non-contiguously bonding polymer block (A) involving a monomer unit having in a portion of a chemical structure at least one heteroaryl skeleton selected from a thiophene, a fluorine, a carbazole, a dibenzosilole and a dibenzogermole; and a polymer block (B) involving a monomer unit similarly having at least one heteroaryl skeleton; wherein the polymer block (A) comprises a homopolymer block of a monomer unit having a substituent R nA that is an alkoxy group or an alkyl group having 1-18 carbon atoms, and the polymer block (B) comprises a copolymer block of at least two different each other types of monomer units having substituent R nB selected from an alkoxy group or an alkyl group having 1-18 carbon atoms, which may be substituted with an alkoxy group, a halogen atom, a hydroxyl group, an amino group, a thiole group, a silyl group, an ester group, an aryl group, hetero aryl group.

  提供的是一种共轭嵌段共聚物，能够控制形态并实现更高的转化效率。该共轭嵌段共聚物由连续或非连续键合的聚合物块（A）和聚合物块（B）组成，聚合物块（A）包括至少在化学结构的一部分中具有来自噻吩、氟、咔唑、二苯基硅烷和二苯基锗烷中至少一个杂环骨架的单体单元，其中聚合物块（A）包括单体单元的同源聚合物块，该单体单元具有取代基RnA，该取代基为具有1-18个碳原子的烷氧基或烷基，并且聚合物块（B）包括至少两种不同类型的单体单元的共聚物块，该单体单元具有取代基RnB，该取代基为具有1-18个碳原子的烷氧基或烷基，可以用烷氧基、卤素原子、羟基、氨基、硫醇基、硅基、酯基、芳基、杂芳基进行取代。
• ELECTRON CONJUGATED BLOCK COPOLYMER AND PHOTOELECTRIC CONVERSION ELEMENT
  申请人：Kuraray Co., Ltd.

  公开号：EP2706077A1

  公开（公告）日：2014-03-12

  Provided is a conjugated block copolymer that is capable of morphology control and that can achieve superior conversion efficiency. A π-electron conjugated block copolymer contiguously or non-contiguously bonding polymer block (A) involving a monomer unit having in a portion of a chemical structure at least one heteroaryl skeleton selected from a thiophene, a fluorine, a carbazole, a dibenzosilole and a dibenzogermole; and a polymer block (B) involving a monomer unit similarly having at least one heteroaryl skeleton; wherein the polymer block (A) comprises a homopolymer block of a monomer unit having a substituent RnA that is an alkoxy group or an alkyl group having 1 - 18 carbon atoms, and the polymer block (B) comprises a copolymer block of at least two different from each other types of monomer units having substituent RnB selected from an alkoxy group or an alkyl group having 1 - 18 carbon atoms, which may be substituted with an alkoxy group, a halogen atom, a hydroxyl group, an amino group, a thiole group, a silyl group, an ester group, an aryl group, hetero aryl group.

  本发明提供了一种共轭嵌段共聚物，该共聚物能够进行形态控制，并能实现优异的转换效率。一种π-电子共轭嵌段共聚物毗连或非毗连键合聚合物嵌段（A），涉及在部分化学结构中具有至少一个杂芳基骨架的单体单元，该杂芳基骨架选自噻吩、氟、咔唑、二苯并硅唑和二苯并锗；以及涉及同样具有至少一个杂芳基骨架的单体单元的聚合物嵌段（B）；其中聚合物嵌段(A)包括具有取代基 RnA 的单体单元的均聚物嵌段，取代基 RnA 为烷氧基或具有 1-18 个碳原子的烷基，聚合物嵌段(B)包括至少两种不同类型的单体单元的共聚物嵌段，取代基 RnB 选自烷氧基或具有 1-18 个碳原子的烷基、可被烷氧基、卤素原子、羟基、氨基、巯基、硅基、酯基、芳基、杂芳基取代。
• HETEROCYCLE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS
  申请人：ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A.

  公开号：EP1828171B1

  公开（公告）日：2014-03-12
• US7863294B2
  申请人：——

  公开号：US7863294B2

  公开（公告）日：2011-01-04