3-hydroxypropyl diclofenac ester | 120339-20-0

• 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: 3-hydroxypropyl diclofenac ester
• 英文别名: 3-Hydroxypropyl 2-[(2,6-dichlorophenyl)amino]benzeneacetate；3-hydroxypropyl 2-[2-(2,6-dichloroanilino)phenyl]acetate
• CAS: 120339-20-0
• 化学式: C₁₇H₁₇Cl₂NO₃
• 分子量: 354.233
• InChiKey: KWNDNZHDAUZIJT-UHFFFAOYSA-N

物化性质

• 沸点：
  426.9±45.0 °C(Predicted)
• 密度：
  1.348±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  23
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  58.6
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3-hydroxypropyl diclofenac ester 在 吡啶 、 sodium azide 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 40.0h， 生成 3-azidopropionyl diclofenac ester
  参考文献：
  名称：

  Multifunctional Forms of Polyoxazoline Copolymers and Drug Compositions Comprising the Same

  摘要：

  本公开提供了具有两个或三个反应性功能基团的2-取代-2-噁唑烯共聚物，这些功能基团在化学上也是正交的。所述的共聚物可以是随机共聚物、嵌段共聚物或随机和嵌段共聚物配置的混合物。此外，本公开提供了合成上述聚合物的新方法，用于与靶向、诊断和治疗剂等分子结合。

  公开号：

  US20150273074A1
• 作为产物：
  描述：

  双氯芬酸 、 3-溴-1-丙醇 在 caesium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 3-hydroxypropyl diclofenac ester
  参考文献：
  名称：

  Nicotinic acid conjugates of nonsteroidal anti-inflammatory drugs (NSAID’s) and their anti-inflammatory properties

  摘要：

  A series of nicotinic acid conjugates with non-steroidal anti-inflammatory drugs (NSAID's) have been effectively synthesized using TBTU in high yield and purity. All the synthesized conjugates were evaluated for their in vitro anti-inflammatory activity. (C) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ejps.2013.02.007

文献信息

• Multifunctional forms of polyoxazoline copolymers and drug compositions comprising the same
  申请人：SERINA THERAPEUTICS, INC.

  公开号：US10166294B2

  公开（公告）日：2019-01-01

  The present disclosure provides copolymers of 2-substituted-2-oxazolines possessing two or three reactive functional groups which are also chemically orthogonal. The copolymers described may be random copolymers, block copolymers or a mixture of random and block copolymer configurations. Furthermore, the present disclosure provides novel methods for synthesizing the above polymers and for conjugating to molecules such as targeting, diagnostic and therapeutic agents.

  本公开提供了具有两个或三个活性官能团且化学性质正交的 2-取代-2-噁唑啉共聚物。所述共聚物可以是无规共聚物、嵌段共聚物或无规共聚物和嵌段共聚物的混合物。此外，本公开还提供了合成上述聚合物以及与靶向、诊断和治疗剂等分子共轭的新方法。
• MULTIFUNCTIONAL FORMS OF POLYOXAZOLINE COPOLYMERS AND DRUG COMPOSITIONS COMPRISING THE SAME
  申请人：SERINA THERAPEUTICS, INC

  公开号：US20190134208A1

  公开（公告）日：2019-05-09

  The present disclosure provides copolymers of 2-substituted-2-oxazolines possessing two or three reactive functional groups which are also chemically orthogonal. The copolymers described may be random copolymers, block copolymers or a mixture of random and block copolymer configurations. Furthermore, the present disclosure provides novel methods for synthesizing the above polymers and for conjugating to molecules such as targeting, diagnostic and therapeutic agents.
• US8101706B2
  申请人：——

  公开号：US8101706B2

  公开（公告）日：2012-01-24
• US8501899B2
  申请人：——

  公开号：US8501899B2

  公开（公告）日：2013-08-06
• Nicotinic acid conjugates of nonsteroidal anti-inflammatory drugs (NSAID’s) and their anti-inflammatory properties
  作者：Machhindra Gund、Fazlur-Rahman Nawaz Khan、Amit Khanna、Varadhan Krishnakumar

  DOI：10.1016/j.ejps.2013.02.007

  日期：2013.5

  A series of nicotinic acid conjugates with non-steroidal anti-inflammatory drugs (NSAID's) have been effectively synthesized using TBTU in high yield and purity. All the synthesized conjugates were evaluated for their in vitro anti-inflammatory activity. (C) 2013 Elsevier B.V. All rights reserved.