N-丙基二硫代氨基甲酸 | 20562-15-6

• 分子结构分类: 有机化合物 - 有机硫化合物
• 中文名称: N-丙基二硫代氨基甲酸
• 英文名称: N-propyl-dithioformic acid
• 英文别名: N-Propyl-dithiocarbaminsaeure；N-propyldithiocarbamic acid；propyl-dithiocarbamic acid；Propyl-dithiocarbamidsaeure；Propylcarbamodithioic acid
• CAS: 20562-15-6
• 化学式: C₄H₉NS₂
• mdl: MFCD19216974
• 分子量: 135.254
• InChiKey: TWIOETHNYAHVFS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  7
• 可旋转键数：
  2
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  45.1
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  N-丙基二硫代氨基甲酸 在 透明紫BS 、 三乙胺 作用下， 以 四氢呋喃 为溶剂， 反应 3.0h， 生成 异氰酸丙酯
  参考文献：
  名称：

  Yamamoto, Tamotsu; Terada, Atsushi; Muramatsu, Takashi, Organic Preparations and Procedures International, 1994, vol. 26, # 5, p. 555 - 557

  摘要：

  DOI：
• 作为产物：
  描述：

  正丙胺 、 二硫化碳 以 氯仿 为溶剂， 反应 3.0h， 生成 N-丙基二硫代氨基甲酸
  参考文献：
  名称：

  Multiple-structured nanocrystals towards bifunctional photoluminescent-superhydrophobic surfaces

  摘要：

  我们报告了一种简单有效的策略，通过一种方便的界面自组装技术，制备具有光致发光和疏水性特征的多样化二硫代氨基甲酸盐功能化CdS纳米晶体（NCs）层次结构。巯基乙酸（TGA）与二硫代氨基甲酸盐在双相界面上的配体交换反应赋予CdS多样的形态。同时，经过界面自组装后的二硫代氨基甲酸盐功能化纳米晶体在光化学稳定性和光致发光（PL）方面相较于原始纳米晶体表现出良好的性能。此外，引入具有长烷基链的二硫代氨基甲酸盐配体可以显著增强纳米晶体的疏水性。通过简单地改变具有不同内在疏水特性的定向配体，可以制造出由荧光纳米晶体构建的超级疏水表面。

  DOI：

  10.1039/b926761a

文献信息

• Efficient One-pot Synthesis of Alkyl 3-(alkyl)-4-methyl-2-thioxo-2,3-dihydrothiazole-5-carboxylates in a Multi Component Reaction
  作者：Nasir Iravani、Jalal Albadi、Somaieh Varnaseri、Zahra Jaberi、Nahid Karami、Marzieh Khadamati

  DOI：10.1002/jccs.201200109

  日期：2012.12

  A simple and efficient one‐pot synthesis of alkyl 2‐(alkyl)‐4‐methyl‐2‐thioxo‐2,3‐dihydrothiazole‐5‐carboxylates from the reaction of primary alkylamines and carbon disulfide in the presence of 2‐chloro‐1,3‐dicarbonyl compounds is described. This new protocol has several advantages such as lack of necessity of the catalyst, good yields, mild conditions and short times for reaction.

  由伯烷基胺和二硫化碳在2-氯-存在下的反应简单，高效地一锅法合成2-（烷基）-4-甲基-2-硫代-2-2,3-二氢噻唑-5-羧酸烷基酯描述了1,3-二羰基化合物。该新方案具有许多优点，例如不需要催化剂，产率高，条件温和且反应时间短。
• Datta,K. et al., Bulletin de la Societe Chimique de France, 1974, p. 2135 - 2140
  作者：Datta,K. et al.

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  日期：——
• Synthesis, antifungal activities and molecular docking studies of novel 2-(2,4-difluorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl dithiocarbamates
  作者：Yan Zou、Shichong Yu、Renwu Li、Qingjie Zhao、Xiang Li、Maocheng Wu、Ting Huang、Xiaoxun Chai、Honggang Hu、Qiuye Wu

  DOI：10.1016/j.ejmech.2014.01.009

  日期：2014.3

  A series of 2-(2,4-difluorophenyl)-2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propyl dithiocarbamates as new analogs of fluconazole were synthesized and their antifungal activities were evaluated. Among these compounds, 2a-f and 3a-q exhibited higher activities than fluconazole against nearly all fungi tested except Aspergillus fumigatus. Noticeably, the in vitro biological activities of 2b, 3a, 3c, 3h-k, and 3o-q against Candida species were much better than those of fluconazole and ketoconazole. Also, 2a-d, 3a-d, 3e-f, 3h-k, 3p and 3q showed higher activities against A. fumi than fluconazole. Computational docking experiments indicated that the inhibition of CYP51 involved a coordination bond with iron of the heme group, the hydrophilic H-bonding region, the hydrophobic region, and the narrow hydrophobic cleft. (C) 2014 Elsevier Masson SAS. All rights reserved.
• Design, synthesis, molecular docking and biological evaluation of new dithiocarbamates substituted benzimidazole and chalcones as possible chemotherapeutic agents
  作者：Keerthana Bacharaju、Swathi Reddy Jambula、Sreekanth Sivan、Saritha JyostnaTangeda、Vijjulatha Manga

  DOI：10.1016/j.bmcl.2012.03.018

  日期：2012.5

  A series of novel dithiocarbamates with benzimidazole and chalcone scaffold have been designed synthesised and evaluated for their antimitotic activity. Compounds 4c and 9d display the most promising antimitotic activity with IC50 of 1.66 mu M and 1.52 mu M respectively. (C) 2012 Elsevier Ltd. All rights reserved.
• Tulyupa, F. M.; Tkacheva, L. M.; Usatenko, Yu. I., Soviet progress in chemistry, 1969, vol. 35, # 5, p. 8 - 10
  作者：Tulyupa, F. M.、Tkacheva, L. M.、Usatenko, Yu. I.

  DOI：——

  日期：——