[3-(2-Formyl-4-oxochromen-5-yl)oxy-2-hydroxypropyl] 4-methylbenzenesulfonate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: [3-(2-Formyl-4-oxochromen-5-yl)oxy-2-hydroxypropyl] 4-methylbenzenesulfonate
• 英文别名: [3-(2-formyl-4-oxochromen-5-yl)oxy-2-hydroxypropyl] 4-methylbenzenesulfonate
• 化学式: C₂₀H₁₈O₈S
• 分子量: 418.4
• InChiKey: ICRNLXNYTMUAAO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  29
• 可旋转键数：
  8
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  125
• 氢给体数：
  1
• 氢受体数：
  8

文献信息

• [EN] CROMOLYN DERIVATIVES AND RELATED METHODS OF IMAGING AND TREATMENT<br/>[FR] DÉRIVÉS D'ACIDE CROMOGLYCIQUE ET PROCÉDÉS ASSOCIÉS D'IMAGERIE ET DE TRAITEMENT
  申请人：GEN HOSPITAL CORP

  公开号：WO2010088455A2

  公开（公告）日：2010-08-05

  Novel cromolyn analogs useful as imaging agents for detecting atherosclerotic plaques and for treating atherosclerosis and Alzheimer's Disease, and methods of making the cromolyn analogs, are disclosed. The cromolyn analogs have the general formula (I), or formula (II); wherein X is OH, C1-C6 alkoxyl, 18F, or 19F; Y and Z are independently selected from a C1-C6 alkyl, C1C6 alkoxyl, halogen, un-substituted or C1-C6 substituted amine, 18F, 19F, or H; and n is 1, 2, or 3; and wherein for structure (I), if n are both 1 and Y and Z are both H, X is not OH.