8-Chloro-2-(2-chlorophenyl)-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine | 1160496-30-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并硫氮卓类
• 英文名称: 8-Chloro-2-(2-chlorophenyl)-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine
• CAS: 1160496-30-9
• 化学式: C₁₉H₁₃Cl₂NS₂
• 分子量: 390.357
• InChiKey: FZMBZQOVGWFQAV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.7
• 重原子数：
  24
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  65.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-氨基-5-氯噻吩 、 3-(2-chlorophenyl)-1-(2-thienyl)-2-propenone 在 盐酸 作用下， 以 乙醇 为溶剂， 以59%的产率得到8-Chloro-2-(2-chlorophenyl)-4-thiophen-2-yl-2,5-dihydro-1,5-benzothiazepine
  参考文献：
  名称：

  Syntheses of 1,5-Benzothiazepines: Part XXXVI—Syntheses and Antimicrobial Evaluation of 2-(2-Chlorophenyl)-4-(4-chlorophenyl/2-thienyl)-2,5-dihydro-8-substituted-1,5-benzothiazepines

  摘要：

  Six 5-substituted-2-aminobenzenethiols have been reacted with 3-(2-chlorophenyl)-1-(4-chlorophenyl)-2-propenone and 3-(2-chlorophenyl)-1-(2-thienyl)-2-propenone in dry ethanol saturated with dry HCl gas, to obtain twelve new compounds, 8-substituted-2-(2-chlorophenyl)-4-(4-chlorophenyl/2-thienyl)-2,5-dihydro-1,5-benzothiazepines in satisfactory yields. The structures of the final products have been assigned by elemental microanalyses data for elements, C, H, and N and by IR, 1H NMR, and mass spectroscopies. The synthesized compounds have been evaluated for their relative antimicrobial activity against the gram-positive bacteria, Staphylococcus aureus, gram-negative bacteria, Pseudomonas aeruginosa and the fungus, Candida albicans. The compounds have been found to show little antibacterial activity, but interestingly, showed significant antifungal activity.

  DOI：

  10.1080/10426500802048920