3-propyl-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine | 54025-83-1

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 3-propyl-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
• 英文别名: 6-phenyl-3-n-propyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine；6-phenyl-3-propyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine；6-phenyl-3-propyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
• CAS: 54025-83-1
• 化学式: C₁₃H₁₄N₄S
• mdl: MFCD00128573
• 分子量: 258.347
• InChiKey: GVWYTMWYSYQVJG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  68.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-溴苯乙酮 、 4-氨基-5-异丙基-4H-1,2,4-三唑-3-硫醇 反应 0.02h， 以87%的产率得到3-propyl-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
  参考文献：
  名称：

  3-烷基-6-芳基[1,2,4]三唑并[3,4-b][1,3,4]噻二嗪的微波辅助无溶剂合成

  摘要：

  报告了一种有效的微波辅助无溶剂合成 3-烷基-6-芳基 [1,2,4] 三唑并 [3,4-b][1,3,4] 噻二嗪衍生物。已经在很短的反应时间内以极好的收率合成了 12 种衍生物。

  DOI：

  10.3184/030823407x198203

文献信息

• α,α-Dibromoacetophenones mediated synthesis of some new 7H-7-alkoxy-3-alkyl/phenyl-6-aryl-s-triazolo[3,4-b][1,3,4]thiadiazines and their antimicrobial evaluation
  作者：Rashmi Pundeer、Vijay Kiran、Richa Prakash、Sushma、Subhash C. Bhatia、Chetan Sharma、Kamal R. Aneja

  DOI：10.1007/s00044-011-9945-1

  日期：2012.12

  A series of new 7H-7-alkoxy-3-alkyl/phenyl-6-aryl-s-triazolo[3,4-b][1,3,4]thiadiazines (3, 4) were synthesized by the reaction of various alpha,alpha-dibromoacetophenones 1 with 3-alkyl/phenyl-4-amino-5-mercapto-s-triazoles (2) in different alcoholic solvents in good yields. All the newly synthesized compounds (3, 4) were screened for their in vitro antibacterial and antifungal activity. Biological activities of these compounds were compared with those of the commercially available antibiotic, ciprofloxacin and antifungal agent, amphotericin-B. The title compounds showed good activity against the Gram-positive bacteria, Staphylococcus aureus and Bacillus subtilis and the yeasts, Saccharomyces cerevisiae and Candida albicans.
• Dhaka,K.S. et al., Indian Journal of Chemistry, 1974, vol. 12, p. 287 - 289
  作者：Dhaka,K.S. et al.

  DOI：——

  日期：——
• Novel and Efficient Solid‐State Synthesis of 3‐Alkyl‐6‐Aryl‐<i>s</i>‐triazolo[3,4‐<i>b</i>]‐1,3,4‐thiadiazine Derivatives
  作者：Xin‐Ping Hui、Ren‐Zhong Qiao、Peng‐Fei Xu、Zi‐Yi Zhang

  DOI：10.1080/00397910600616461

  日期：2006.7

  A novel and efficient solid-state synthesis of s -triazolo[3,4- b ]-1,3,4-thiadiazine derivatives has been reported. Twelve 3-alkyl-6-aryl- s -triazolo[3,4- b ]-1,3,4-thiadiazine derivatives have been synthesized in excellent yields with short reaction time.
• DHAKA K. S.; MOHAN J.; CHADHA V. K.; PUJARI H. K., INDIAN J. CHEM. <IJOC-AP>, 1974, 12, NO 3, 287-289
  作者：DHAKA K. S.、 MOHAN J.、 CHADHA V. K.、 PUJARI H. K.

  DOI：——

  日期：——
• Microwave-assisted Solvent-free Synthesis of 3-alkyl-6-aryl[1,2,4] triazolo[3,4-b][1,3,4]thiadiazines
  作者：Xin-Ping Hui、Ren-Lin Wang、Zi-Yi Zhang

  DOI：10.3184/030823407x198203

  日期：2007.2

  An efficient microwave-assisted solvent-free synthesis of 3-alkyl-6-aryl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine derivatives is reported. Twelve derivatives have been synthesised in excellent yields in short reaction times.

  报告了一种有效的微波辅助无溶剂合成 3-烷基-6-芳基 [1,2,4] 三唑并 [3,4-b][1,3,4] 噻二嗪衍生物。已经在很短的反应时间内以极好的收率合成了 12 种衍生物。