7-chloro-1,5-benzothiazepin-2,4(3H,5H)-dione | 74569-07-6

• 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: 7-chloro-1,5-benzothiazepin-2,4(3H,5H)-dione
• 英文别名: 7-chloro-5H-1,5-benzothiazepine-2,4-dione
• CAS: 74569-07-6
• 化学式: C₉H₆ClNO₂S
• 分子量: 227.671
• InChiKey: NSKFMLAJPGWTER-UHFFFAOYSA-N

物化性质

• 熔点：
  218 °C (decomp)
• 沸点：
  420.3±45.0 °C(Predicted)
• 密度：
  1.473±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  14
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  71.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  苯肼,盐酸盐 、 7-chloro-1,5-benzothiazepin-2,4(3H,5H)-dione 在 sodium acetate 作用下， 以 乙醇 为溶剂， 反应 1.0h， 以40%的产率得到7-Chloro-2-(phenyl-hydrazono)-2,3-dihydro-5H-benzo[b][1,4]thiazepin-4-one
  参考文献：
  名称：

  Synthesis, antimicrobial and cytostatic activities of some derivatives of indolo[2,3-b]-1,5-benzothiazepine, a novel heterocyclic ring system

  摘要：

  Some derivatives of indolo[2,3-b]-1,5-benzothiazepine, a novel heterocyclic ring system, and of its 5,6-dihydroderivative have been obtained by Fischer indolization of corresponding phenylhydrazones. All the tetracyclic compounds were studied for their antimicrobial and cytostatic activities and several of them showed good activity against Gram-positive bacteria and Cryptococci.

  DOI：

  10.1016/0223-5234(93)90024-9
• 作为产物：
  描述：

  7-chloro-2,3-dihydro-5H-benzo[b][1,4]thiazepin-4-one 在 磺酰氯 、 硫酸 作用下， 以 氯苯 为溶剂， 反应 0.25h， 生成 7-chloro-1,5-benzothiazepin-2,4(3H,5H)-dione
  参考文献：
  名称：

  Ried, Walter; Sell, Gunther, Liebigs Annalen der Chemie, 1980, # 8, p. 1252 - 1258

  摘要：

  DOI：

文献信息

• Ried; Sell, Chemische Berichte, 1980, vol. 113, # 6, p. 2314 - 2317
  作者：Ried、Sell

  DOI：——

  日期：——
• RIED W.; SELL G., CHEM. BER., 1980, 113, NO 6, 2314-2317
  作者：RIED W.、 SELL G.

  DOI：——

  日期：——
• RIED W.; SELL G., LIEBIGS ANN. CHEM., 1980, NO 8, 1252-1258
  作者：RIED W.、 SELL G.

  DOI：——

  日期：——
• Synthesis, antimicrobial and cytostatic activities of some derivatives of indolo[2,3-b]-1,5-benzothiazepine, a novel heterocyclic ring system
  作者：V Ambrogi、A Furlani、G Grandolini、A Papaioannou、L Perioli、V Scarcia、L Tuttobello

  DOI：10.1016/0223-5234(93)90024-9

  日期：——

  Some derivatives of indolo[2,3-b]-1,5-benzothiazepine, a novel heterocyclic ring system, and of its 5,6-dihydroderivative have been obtained by Fischer indolization of corresponding phenylhydrazones. All the tetracyclic compounds were studied for their antimicrobial and cytostatic activities and several of them showed good activity against Gram-positive bacteria and Cryptococci.
• Ried, Walter; Sell, Gunther, Liebigs Annalen der Chemie, 1980, # 8, p. 1252 - 1258
  作者：Ried, Walter、Sell, Gunther

  DOI：——

  日期：——