Ethyl 7-[[5-(2-fluorophenoxy)-4-hydroxypentyl]-methylsulfonylamino]heptanoate | 67587-36-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: Ethyl 7-[[5-(2-fluorophenoxy)-4-hydroxypentyl]-methylsulfonylamino]heptanoate
• CAS: 67587-36-4
• 化学式: C₂₁H₃₄FNO₆S
• 分子量: 447.568
• InChiKey: HZRQSLOGBVRWDS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  30
• 可旋转键数：
  17
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  102
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  Ethyl 7-[[5-(2-fluorophenoxy)-4-hydroxypentyl]-methylsulfonylamino]heptanoate 在 sodium hydroxide 作用下， 以 乙醇 为溶剂， 生成 7-[[5-(2-Fluorophenoxy)-4-hydroxypentyl]-methylsulfonylamino]heptanoic acid
  参考文献：
  名称：

  11,12-Secoprostaglandins. 5. 8-Acetyl- or8-(1-hydroxyethyl)-12-hydroxy-13-aryloxytridecanoic acids and sulfonamide isosteres as inhibitors of platelet aggregation

  摘要：

  The synthesis of a series of 8-acetyl- (or 1-hydroxyethyl-) 12-hydroxy-13-aryloxytridecanoic acids and their sulfonamide isosteres is described. These compounds are formally derived from members of earlier reported series of modified secoprostaglandins by replacing the omega-butyl chain termini by substituted aryloxy groups. A number of these compounds are potent inhibitors of collagen-induced blood platelet aggregation in guinea pigs on oral administration.

  DOI：

  10.1021/jm00208a003
• 作为产物：
  描述：

  ethyl 7-[N-(4,5-epoxypentyl)methanesulfonamido]heptanoate 、 2-氟苯酚 生成 Ethyl 7-[[5-(2-fluorophenoxy)-4-hydroxypentyl]-methylsulfonylamino]heptanoate
  参考文献：
  名称：

  11,12-Secoprostaglandins. 5. 8-Acetyl- or8-(1-hydroxyethyl)-12-hydroxy-13-aryloxytridecanoic acids and sulfonamide isosteres as inhibitors of platelet aggregation

  摘要：

  The synthesis of a series of 8-acetyl- (or 1-hydroxyethyl-) 12-hydroxy-13-aryloxytridecanoic acids and their sulfonamide isosteres is described. These compounds are formally derived from members of earlier reported series of modified secoprostaglandins by replacing the omega-butyl chain termini by substituted aryloxy groups. A number of these compounds are potent inhibitors of collagen-induced blood platelet aggregation in guinea pigs on oral administration.

  DOI：

  10.1021/jm00208a003

文献信息

• US3991106A
  申请人：——

  公开号：US3991106A

  公开（公告）日：1976-11-09
• US4055596A
  申请人：——

  公开号：US4055596A

  公开（公告）日：1977-10-25
• 11,12-Secoprostaglandins. 5. 8-Acetyl- or8-(1-hydroxyethyl)-12-hydroxy-13-aryloxytridecanoic acids and sulfonamide isosteres as inhibitors of platelet aggregation
  作者：John B. Bicking、James H. Jones、Wilbur J. Holtz、Charles M. Robb、Frederick A. Kuehl、David H. Minsker、Edward J. Cragoe

  DOI：10.1021/jm00208a003

  日期：1978.10

  The synthesis of a series of 8-acetyl- (or 1-hydroxyethyl-) 12-hydroxy-13-aryloxytridecanoic acids and their sulfonamide isosteres is described. These compounds are formally derived from members of earlier reported series of modified secoprostaglandins by replacing the omega-butyl chain termini by substituted aryloxy groups. A number of these compounds are potent inhibitors of collagen-induced blood platelet aggregation in guinea pigs on oral administration.