(2,6-Diisopropylphenylsulfamoyl)-acetic Acid Tetradecyl Ester

• 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: (2,6-Diisopropylphenylsulfamoyl)-acetic Acid Tetradecyl Ester
• 英文别名: (2,6-Diisopropyl-phenylsulfamoyl)-acetic acid tetradecyl ester；tetradecyl 2-[[2,6-di(propan-2-yl)phenyl]sulfamoyl]acetate
• 化学式: C₂₈H₄₉NO₄S
• 分子量: 495.767
• InChiKey: CUANVPYNTKAUIO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.3
• 重原子数：
  34
• 可旋转键数：
  20
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  80.8
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  Ethyl [[[2,6-bis(1-methylethyl)phenyl]amino]sulfonyl]acetate 在 氢氧化钾 、 草酰氯 作用下， 以 四氢呋喃 、 乙醇 、 甲苯 为溶剂， 生成 (2,6-Diisopropylphenylsulfamoyl)-acetic Acid Tetradecyl Ester
  参考文献：
  名称：

  Inhibitors of Acyl-CoA:Cholesterol O-acyltransferase (ACAT) as hypocholesterolemic agents: Synthesis and structure-activity relationships of novel series of sulfonamides, acylphosphonamides and acylphosphoramidates

  摘要：

  Sulfoacetic acid, phosphoramidate, and phosphonamide analogs of the ACAT inhibitors, CI-999 and CI-1011 were synthesized. The structure-activity relationships of these compounds as ACAT inhibitors are described. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(98)00011-0

文献信息

• .beta.-carboxy sulfonamide ACAT inhibitors
  申请人：Warner-Lambert Company

  公开号：US05491170A1

  公开（公告）日：1996-02-13

  .beta.-Carboxy sulfonyl compounds of the formula ##STR1## wherein R.sub.1 is aryl, R.sub.3 is hydrogen or alkyl, R.sub.3 and R.sub.4 are hydrogen or alkyl, Y is --O--, --S--, or --NR.sub.2 --, and R.sub.5 is alkyl or aryl are potent inhibitors of the enzyme acyl CoA:cholesterol acyltransferase (ACAT) and are thus useful for treating hypercholesterolemia and atherosclerosis.

  公式为##STR1##的.beta.-羧基磺酰化合物，其中R.sub.1为芳基，R.sub.3为氢或烷基，R.sub.3和R.sub.4为氢或烷基，Y为--O--，--S--或--NR.sub.2--，R.sub.5为烷基或芳基，是酰基辅酶A：胆固醇酰基转移酶（ACAT）的有效抑制剂，因此可用于治疗高胆固醇血症和动脉硬化。
• US5491170A
  申请人：——

  公开号：US5491170A

  公开（公告）日：1996-02-13
• Inhibitors of Acyl-CoA:Cholesterol O-acyltransferase (ACAT) as hypocholesterolemic agents: Synthesis and structure-activity relationships of novel series of sulfonamides, acylphosphonamides and acylphosphoramidates
  作者：H.T Lee、W.H Roark、J.A Picard、D.R Sliskovic、B.D Roth、R.L Stanfield、K.L Hamelehle、R.F Bousley、B.R Krause

  DOI：10.1016/s0960-894x(98)00011-0

  日期：1998.2

  Sulfoacetic acid, phosphoramidate, and phosphonamide analogs of the ACAT inhibitors, CI-999 and CI-1011 were synthesized. The structure-activity relationships of these compounds as ACAT inhibitors are described. (C) 1998 Elsevier Science Ltd. All rights reserved.