[2-Methoxy-5-methyl-3-(2-thioxo-thiazolidine-3-carbonyl)-phenyl]-(2-thioxo-thiazolidin-3-yl)-methanone | 197906-36-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [2-Methoxy-5-methyl-3-(2-thioxo-thiazolidine-3-carbonyl)-phenyl]-(2-thioxo-thiazolidin-3-yl)-methanone
• CAS: 197906-36-8
• 化学式: C₁₆H₁₆N₂O₃S₄
• 分子量: 412.579
• InChiKey: JMZUNFUNNJGSNQ-UHFFFAOYSA-N

物化性质

• 沸点：
  600.3±65.0 °C(Predicted)
• 密度：
  1.55±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.95
• 重原子数：
  25.0
• 可旋转键数：
  3.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  49.85
• 氢给体数：
  0.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  [2-Methoxy-5-methyl-3-(2-thioxo-thiazolidine-3-carbonyl)-phenyl]-(2-thioxo-thiazolidin-3-yl)-methanone 在 三溴化硼 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 51.0h， 生成
  参考文献：
  名称：

  Synthesis of macrocyclic polyhydroxy tetralactams derived from L-tartaric acid and β-hydroxyglutaric acid

  摘要：

  The synthesis of new 16-, 18-, 19- or 20-membered secondary tetralactams with L-tartaric acid or beta-hydroxyglutaric acid moieties is investigated. The stepwise synthesis with an intermediate diamide diamine provides overall good yields (30-55%) compared with other processes using an intermediate diamide diacid or direct macrocyclization. This synthetic pathway leads to symmetrical or unsymmetrical polyhydroxytetralactams with variable hydroxyl group number. Use of mild acylating agents in this approach allows to avoid the protection-deprotection steps of hydroxyl groups. (C) 1997 Elsevier Science.

  DOI：

  10.1016/s0040-4020(97)00896-x
• 作为产物：
  描述：

  2,6-bis(hydroxymethyl)-4-methyl-anisole 在 potassium permanganate 、 氯化亚砜 、 三乙胺 作用下， 以 四氢呋喃 为溶剂， 反应 6.0h， 生成 [2-Methoxy-5-methyl-3-(2-thioxo-thiazolidine-3-carbonyl)-phenyl]-(2-thioxo-thiazolidin-3-yl)-methanone
  参考文献：
  名称：

  Synthesis of macrocyclic polyhydroxy tetralactams derived from L-tartaric acid and β-hydroxyglutaric acid

  摘要：

  The synthesis of new 16-, 18-, 19- or 20-membered secondary tetralactams with L-tartaric acid or beta-hydroxyglutaric acid moieties is investigated. The stepwise synthesis with an intermediate diamide diamine provides overall good yields (30-55%) compared with other processes using an intermediate diamide diacid or direct macrocyclization. This synthetic pathway leads to symmetrical or unsymmetrical polyhydroxytetralactams with variable hydroxyl group number. Use of mild acylating agents in this approach allows to avoid the protection-deprotection steps of hydroxyl groups. (C) 1997 Elsevier Science.

  DOI：

  10.1016/s0040-4020(97)00896-x