5-heptyl-4-methyl-4H-[1,2,4]-triazole-3-thiol | 856429-14-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 5-heptyl-4-methyl-4H-[1,2,4]-triazole-3-thiol
• 英文别名: 3-heptyl-4-methyl-1H-1,2,4-triazole-5-thione
• CAS: 856429-14-6
• 化学式: C₁₀H₁₉N₃S
• 分子量: 213.347
• InChiKey: OELDLOUMPDAPLN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  14
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  59.7
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  5-heptyl-4-methyl-4H-[1,2,4]-triazole-3-thiol 在 (2,2'-bipyridine)nickel(II) dibromide 作用下， 以 四氢呋喃 、 乙醇 为溶剂， 以92%的产率得到{4-[4-(5-heptyl-4-methyl-4H-[1,2,4]-triazol-3-ylsulphanyl)-2-propoxybenzylamino]phenyl}acetic acid ethyl ester
  参考文献：
  名称：

  [EN] NOVEL COMPOUNDS WHICH ARE MODULATORS OF THE PPAR-TYPE RECEPTORS AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS
  [FR] NOUVEAUX COMPOSES CONSTITUANT DES MODULATEURS DES RECEPTEURS DU TYPE PPAR ET LEUR UTILISATION DANS DES COMPOSITIONS PHARMACEUTIQUES OU COSMETIQUES

  摘要：

  公开号：

  WO2005058844A3
• 作为产物：
  描述：

  4-甲基氨基硫脲 、 辛酰氯 在 氢氧化钾 作用下， 以 四氢呋喃 、 水 为溶剂， 反应 3.0h， 以90%的产率得到5-heptyl-4-methyl-4H-[1,2,4]-triazole-3-thiol
  参考文献：
  名称：

  [EN] NOVEL COMPOUNDS WHICH ARE MODULATORS OF THE PPAR-TYPE RECEPTORS AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS
  [FR] NOUVEAUX COMPOSES CONSTITUANT DES MODULATEURS DES RECEPTEURS DU TYPE PPAR ET LEUR UTILISATION DANS DES COMPOSITIONS PHARMACEUTIQUES OU COSMETIQUES

  摘要：

  公开号：

  WO2005058844A3

文献信息

• Novel modulators of the PPAR-type receptors and pharmaceutical/cosmetic applications thereof
  申请人：Diaz Philippe

  公开号：US20070054907A1

  公开（公告）日：2007-03-08

  Novel compounds that are modulators of PPAR-type receptors having the structural formula (I): are formulated into pharmaceutical compositions suited for administration in human or veterinary medicine (in dermatology, and in the field of cardiovascular diseases, immune diseases and/or diseases linked to the metabolism of lipids), or, alternatively, into cosmetic compositions.

  具有结构式（I）的调节PPAR型受体的新化合物被制成适用于人类或兽医药物的制剂（在皮肤科、心血管疾病、免疫疾病和/或与脂质代谢相关的疾病中），或者制成化妆品制剂。
• Modulators of the PPAR-type receptors and pharmaceutical/cosmetic applications thereof
  申请人：Galderma Research & Development

  公开号：US07829588B2

  公开（公告）日：2010-11-09

  Novel compounds that are modulators of PPAR-type receptors having the structural formula (I): are formulated into pharmaceutical compositions suited for administration in human or veterinary medicine (in dermatology, and in the field of cardiovascular diseases, immune diseases and/or diseases linked to the metabolism of lipids), or, alternatively, into cosmetic compositions.

  具有结构式(I)的调节PPAR型受体的新化合物被制成适用于人类或兽医药学（在皮肤科，心血管疾病领域，免疫疾病和/或与脂质代谢有关的疾病）的制药组合物，或者制成化妆品组合物。
• A lithographic printing plate precursor and monomer
  申请人：AGFA GRAPHICS NV

  公开号：EP2883699A1

  公开（公告）日：2015-06-17

  A lithographic printing plate precursor is disclosed including (i) a support having a hydrophilic surface or which is provided with a hydrophilic layer, and (ii) a coating including a photopolymerisable layer, characterised in that the photopolymerisable layer comprises a compound comprising at least one moiety having a structure according to Formula (I): wherein X represents O or NR* and R* represents hydrogen, an optionally substituted alkyl, aryl, aralkyl or heteroaryl group; and * denotes the linking positions to the rest of the compound. The application further discloses a monomer including at least one moiety having a structure according to Formula (I) and at least one moiety having a structure according to Formula (VIII): wherein X represents O or NR* and wherein R* represents hydrogen, or an optionally substituted alkyl, aryl, aralkyl or heteroaryl group; R5 represents hydrogen or an optionally substituted alkyl group; and * denotes the linking positions to the rest of the monomer.

  本发明公开了一种平版印刷板前体，包括：(i) 具有亲水性表面或提供亲水层的支撑物；(ii) 包括可光聚合层的涂层、 其特征在于，可光聚合层包括一种化合物，该化合物至少包含一个具有式 (I) 结构的分子： 其中 X 代表 O 或 NR*，R* 代表氢、任选取代的烷基、芳基、芳烷基或杂芳基；以及 * 表示与化合物其余部分的连接位置。 该申请进一步公开了一种单体，包括至少一个具有式（I）结构的分子和至少一个具有式（VIII）结构的分子： 其中 X 代表 O 或 NR*，R* 代表氢或任选取代的烷基、芳基、芳烷基或杂芳基；R5 代表氢或任选取代的烷基；* 表示与单体其余部分的连接位置。
• A LITHOGRAPHIC PRINTING PLATE PRECURSOR
  申请人：AGFA NV

  公开号：EP3392709A1

  公开（公告）日：2018-10-24

  A negative-working lithographic printing plate precursor is disclosed including (i) a support having a hydrophilic surface or which is provided with a hydrophilic layer, and (ii) a coating including a photopolymerisable layer including a photoinitiator and a polymerizable compound, characterised in that the photoinitiator includes at least one structural moiety including an oligo- or poly(alkyleneglycol).

  本发明公开了一种底片工作平版印刷板前体，包括：(i) 具有亲水性表面或提供亲水层的支撑物；(ii) 包括光引发剂和可聚合化合物在内的可光聚合层的涂层，其特征在于光引发剂包括至少一个结构分子，其中包括低聚或聚亚烷基乙二醇。
• A LITHOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD FOR MAKING HYDROPHOBIC RESIN PARTICLES
  申请人：AGFA NV

  公开号：EP3815900A1

  公开（公告）日：2021-05-05

  A lithographic printing plate precursor including a support and a coating comprising a polymerisable compound, optionally a sensitizer, a photoinitiator and discrete particles is disclosed wherein the discrete particles comprise a crosslinked hydrophobic polymer backbone and a plurality of hydrophobic pendant grafts and a method for making a particulate resin particle including a hydrophobic backbone and hydrophobic grafts attached thereto.

  本发明公开了一种平版印刷板前驱体，包括支撑物和涂层，涂层包括可聚合化合物、感光剂、光引发剂和离散颗粒，其中离散颗粒包括交联疏水聚合物骨架和多个疏水悬垂接枝，还公开了一种制造颗粒状树脂颗粒的方法，颗粒状树脂颗粒包括疏水骨架和附着其上的疏水接枝。