2,4-Dichloro-6-(2-methoxy-ethoxymethoxy)-benzaldehyde | 99667-63-7

• 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: 2,4-Dichloro-6-(2-methoxy-ethoxymethoxy)-benzaldehyde
• 英文别名: 2,4-Dichloro-6-(2-methoxyethoxymethoxy)benzaldehyde
• CAS: 99667-63-7
• 化学式: C₁₁H₁₂Cl₂O₄
• 分子量: 279.12
• InChiKey: DTBRTPRCWUTNNY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  17
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  44.8
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2,4-Dichloro-6-(2-methoxy-ethoxymethoxy)-benzaldehyde 、 生成 (E)-3-[2,4-dichloro-6-(2-methoxyethoxymethoxy)phenyl]prop-2-enal
  参考文献：
  名称：

  HOFFMAN, W. F.;ALBERTS, A. W.;CRAGOE, E. J. ,, JR.;DEANA, A. A.;EVANS, B.+, J. MED. CHEM., 1986, 29, N 2, 159-169

  摘要：

  DOI：
• 作为产物：
  描述：

  4,6-二氯水杨醛 、 alkaline earth salt of/the/ methylsulfuric acid 在 potassium carbonate 作用下， 生成 2,4-Dichloro-6-(2-methoxy-ethoxymethoxy)-benzaldehyde
  参考文献：
  名称：

  3-Hydroxy-3-methylglutaryl-coenzyme A reductase inhibitors. 2. Structural modification of 7-(substituted aryl)-3,5-dihydroxy-6-heptenoic acids and their lactone derivatives

  摘要：

  A series of 7-(substituted aryl)-3,5-dihydroxy-6-heptenoic (heptanoic) acids and their lactone derivatives have been prepared and tested for inhibition of 3-hydroxy-3-methylglutaryl-coenzyme A reductase in vitro. A systematic exploration of the structure-activity relationships in this series led to the synthesis of (+)-trans-(E)-6-[2-[2,4-dichloro-6-[(4-fluorophenyl) methoxyl]phenyl]ethyl]-3,4,5,6-tetrahydro-4-hydroxy-2H-pyran-2-one (66(+)), which has one-half of the inhibitory activity of compactin.

  DOI：

  10.1021/jm00152a001

文献信息

• 3-Hydroxy-3-methylglutaryl-coenzyme A reductase inhibitors. 2. Structural modification of 7-(substituted aryl)-3,5-dihydroxy-6-heptenoic acids and their lactone derivatives
  作者：William F. Hoffman、A. W. Alberts、E. J. Cragoe、A. A. Deana、B. E. Evans、J. L. Gilfillan、N. P. Gould、J. W. Huff、F. C. Novello

  DOI：10.1021/jm00152a001

  日期：1986.2

  A series of 7-(substituted aryl)-3,5-dihydroxy-6-heptenoic (heptanoic) acids and their lactone derivatives have been prepared and tested for inhibition of 3-hydroxy-3-methylglutaryl-coenzyme A reductase in vitro. A systematic exploration of the structure-activity relationships in this series led to the synthesis of (+)-trans-(E)-6-[2-[2,4-dichloro-6-[(4-fluorophenyl) methoxyl]phenyl]ethyl]-3,4,5,6-tetrahydro-4-hydroxy-2H-pyran-2-one (66(+)), which has one-half of the inhibitory activity of compactin.
• HOFFMAN, W. F.;ALBERTS, A. W.;CRAGOE, E. J. ,, JR.;DEANA, A. A.;EVANS, B.+, J. MED. CHEM., 1986, 29, N 2, 159-169
  作者：HOFFMAN, W. F.、ALBERTS, A. W.、CRAGOE, E. J. ,, JR.、DEANA, A. A.、EVANS, B.+

  DOI：——

  日期：——