octadecyl-thiourea | 60585-75-3

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫脲类
• 英文名称: octadecyl-thiourea
• 英文别名: Octadecyl-thioharnstoff；Octadecylthiourea
• CAS: 60585-75-3
• 化学式: C₁₉H₄₀N₂S
• 分子量: 328.606
• InChiKey: MUMPVFSPTOSJCO-UHFFFAOYSA-N

物化性质

• 熔点：
  112 °C
• 沸点：
  431.5±28.0 °C(Predicted)
• 密度：
  0.913±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  8.4
• 重原子数：
  22
• 可旋转键数：
  17
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.95
• 拓扑面积：
  70.1
• 氢给体数：
  2
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  octadecyl-thiourea 生成 (4-bromo-phenyl)-(2-octadecylamino-thiazol-5-yl)-methanone
  参考文献：
  名称：

  取代的2-氨基噻唑的合成

  摘要：

  描述了4-和5-酰基-和芳酰基-2-取代的氨基噻唑的制备。讨论了硫脲与酰基卤的缩合生成4,5-二取代-2-氨基噻唑和7-（4 H）苯并噻唑酮。还包括各种中间体的分离和机理途径的讨论。许多2-苯胺基或2-苄基-4-或5-芳酰基噻唑具有中等的口服抗结核活性（2）。

  DOI：

  10.1002/jhet.5570160718
• 作为产物：
  描述：

  十八烷基异氰酸酯 在 氨 、 水 作用下， 生成 octadecyl-thiourea
  参考文献：
  名称：

  Schmidt; Fehr, Justus Liebigs Annalen der Chemie, 1959, vol. 621, p. 1,7

  摘要：

  DOI：

文献信息

• Substituted 2-Thioxoimidazolidin-4-ones and Imidazolidine-2,4-diones as Fatty Acid Amide Hydrolase Inhibitors Templates
  作者：Giulio G. Muccioli、Nicola Fazio、Gerhard K. E. Scriba、Wolfgang Poppitz、Fabio Cannata、Jacques H. Poupaert、Johan Wouters、Didier M. Lambert

  DOI：10.1021/jm050977k

  日期：2006.1.1

  The demonstration of the essential role of fatty acid amide hydrolase (FAAH) in hydrolyzing endogenous bioactive fatty acid derivatives has launched the quest for the discovery of inhibitors for this enzyme. Along this line, a set of 58 imidazolidine-2,4-dione and 2-thioxoirnidazolidin-4-one derivatives was evaluated as FAAH inhibitors. Among these compounds, 3-substituted 5,5'-diplietiylimidazolidine-2,4-dione and 3-substituted 5,5'-diphenyl-2-thioxoimidazolidin-4-one derivatives were previously described as CB, cannabinoid receptor ligands. In the present study, we synthesized several derivatives exhibiting interesting FAAH inhibitory activity and devoid of affinity for the CB, and CB, cannabinoid receptors. For instance, 3-heptyl-5,5'-diphenylimidazolidine-2,4-dione (14) and 5.5'-diphenyl-3-tetradecyl-2-thioxo-imidazolidin-4-one (46) showed pI(50) values of 5.12 and 5.94, respectively. In conclusion, it appears that even though several 3-substituted 5,5'-diphenyl-2-thioxoimidazolidin-4-one and 3-substituted 5.5'-diphenylimidazolidine-2,4-dione derivatives have been previously shown to behave as CB, cannabinoid receptor ligands, appropriate substitutions of these templates can result in FAAH inhibitors devoid of affinity for the cannabinoid receptors.
• Notes - Reactions of Long-Chain Amines. VI. Preparation of Thioureas
  作者：J. Erickson

  DOI：10.1021/jo01110a611

  日期：1956.4
• LIN Y.; SEIFERT C. M.; KANG S. M.; DUSZA J. P.; LANG S. A. JR., J. HETEROCYCL. CHEM., 1979, 16, NO 7, 1377-1383
  作者：LIN Y.、 SEIFERT C. M.、 KANG S. M.、 DUSZA J. P.、 LANG S. A. JR.

  DOI：——

  日期：——
• US3964939A
  申请人：——

  公开号：US3964939A

  公开（公告）日：1976-06-22
• The synthesis of substituted 2-aminothiazoles
  作者：Yang-i Lin、C. M. Seifert、S. M. Kang、J. P. Dusza、S. A. Lang

  DOI：10.1002/jhet.5570160718

  日期：1979.11

  The preparation of 4- and 5-acyl- and aroyl-2-substituted aminothiazoles is described. The condensation of thioureas with acyl halides leading to 4,5-disubstituted-2-aminothiazoles and 7-(4H)benzothiazolones is discussed. A discussion of the isolation of various intermediates and the mechanistic pathway is also included. A number of 2-anilino or 2-benzyl-4- or 5-aroylthiazoles possessed moderate oral

  描述了4-和5-酰基-和芳酰基-2-取代的氨基噻唑的制备。讨论了硫脲与酰基卤的缩合生成4,5-二取代-2-氨基噻唑和7-（4 H）苯并噻唑酮。还包括各种中间体的分离和机理途径的讨论。许多2-苯胺基或2-苄基-4-或5-芳酰基噻唑具有中等的口服抗结核活性（2）。