1-[4-(2,3-epoxy-propoxy)-2-hydroxy-phenyl]-ethanone | 61270-24-4

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-[4-(2,3-epoxy-propoxy)-2-hydroxy-phenyl]-ethanone
• 英文别名: 1-[4-(2,3-Epoxy-propoxy)-2-hydroxy-phenyl]-aethanon；4'-(2,3-epoxy)propoxy-2'-hydroxy-acetophenone；1-{2-Hydroxy-4-[(oxiran-2-yl)methoxy]phenyl}ethan-1-one；1-[2-hydroxy-4-(oxiran-2-ylmethoxy)phenyl]ethanone
• CAS: 61270-24-4
• 化学式: C₁₁H₁₂O₄
• 分子量: 208.214
• InChiKey: VXUDPFWPFSKUFA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  59.1
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-[4-(2,3-epoxy-propoxy)-2-hydroxy-phenyl]-ethanone 生成 ethyl 7-[3-(4-acetyl-3-hydroxyphenoxy)-2-hydroxypropoxy]-4-oxochromene-2-carboxylate
  参考文献：
  名称：

  APPLETON R. A.; BANTICK J. R.; CHAMBERLAIN T. R.; HARDERN D. N.; LEE T. B+, J. MED. CHEM. , 1977, 20, NO 3, 371-379

  摘要：

  DOI：
• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 在 sodium hydroxide 作用下， 生成 1-[4-(2,3-epoxy-propoxy)-2-hydroxy-phenyl]-ethanone
  参考文献：
  名称：

  130.苯乙酮的甘油醚

  摘要：

  DOI：

  10.1039/jr9360000589

文献信息

• Leucotriene antagonists
  申请人：American Home Products Corporation

  公开号：US04448729A1

  公开（公告）日：1984-05-15

  The compounds ##STR1## wherein each X is, independently, --O-- or --NR.sub.5, in which R.sub.5 is hydrogen or alkyl; R is alkyl, R.sub.1 is hydrogen or alkyl, R.sub.2 is hydrogen, hydroxy, amino, alkylamino, dialkylamino or alkanoylamino and when m or n is O, R.sub.2 is hydroxymethyl, aminomethyl, alkylaminomethyl, dialkylaminomethyl or alkanoylaminomethyl; R.sub.3 is hydrogen, --CN, --CONH.sub.2 or --CO.sub.2 M in which M is hydrogen, alkyl or ##STR2## in which p is an integer from 2 to 6 and R.sub.6 and R.sub.7 are, independently, hydrogen or alkyl; R.sub.4 is --NH.sub.2, --NHCOR.sub.8 in which R.sub.8 is alkyl, --NHCOCO.sub.2 Z or --NHCOCH.sub.2 CH.sub.2 CO.sub.2 Z in which Z is hydrogen or alkyl; m and n are 0, 1, 2, 3 or 4 such that when n is from 1 to 4, m is 0 or 1 and when m is from 1 to 4, n is 0 or 1; or pharmaceutically acceptable salts thereof are leucotriene antagonists useful as antiallergy agents.

  化合物##STR1##其中每个X分别为--O--或--NR.sub.5，其中R.sub.5为氢或烷基；R为烷基，R.sub.1为氢或烷基，R.sub.2为氢，羟基，氨基，烷基氨基，二烷基氨基或脂肪酰氨基，当m或n为O时，R.sub.2为羟甲基，氨甲基，烷基氨甲基，二烷基氨甲基或脂肪酰胺基甲基；R.sub.3为氢，--CN，--CONH.sub.2或--CO.sub.2 M，其中M为氢，烷基或##STR2##其中p为2至6的整数，R.sub.6和R.sub.7分别为氢或烷基；R.sub.4为--NH.sub.2，--NHCOR.sub.8，其中R.sub.8为烷基，--NHCOCO.sub.2 Z或--NHCOCH.sub.2 CH.sub.2 CO.sub.2 Z，其中Z为氢或烷基；m和n为0、1、2、3或4，使得当n为1至4时，m为0或1，当m为1至4时，n为0或1；或其药学上可接受的盐是可用作抗过敏药物的白三烯拮抗剂。
• Synthesis of functionalized acetophenones as protein tyrosine phosphatase 1B inhibitors
  作者：Manish Dixit、Brajendra K. Tripathi、Arvind K. Srivastava、Atul Goel

  DOI：10.1016/j.bmcl.2005.05.024

  日期：2005.7

  Protein tyrosine phosphatase 1B (PTP1B) is an enzyme that plays a critical role in down-regulating insulin signaling through dephosphorylation of the insulin receptor. Studies have shown that PTP1B knock-out mice showed increased insulin sensitivity in muscle and liver as well as resistance to obesity. A series of functionalized acetophenones were synthesized and evaluated for their PTP1B inhibitory activity. Some of the screened compounds displayed good inhibitory activity. (c) 2005 Elsevier Ltd. All rights reserved.
• US4448729A
  申请人：——

  公开号：US4448729A

  公开（公告）日：1984-05-15
• 130. Glycerol ethers of resacetophenone
  作者：D. R. Nadkarni、T. S. Wheeler

  DOI：10.1039/jr9360000589

  日期：——
• APPLETON R. A.; BANTICK J. R.; CHAMBERLAIN T. R.; HARDERN D. N.; LEE T. B+, J. MED. CHEM. <JMCM-AR>, 1977, 20, NO 3, 371-379
  作者：APPLETON R. A.、 BANTICK J. R.、 CHAMBERLAIN T. R.、 HARDERN D. N.、 LEE T. B+

  DOI：——

  日期：——