methyl 4-<2-(1,1-dimethylethoxy)-2-oxethoxy>phenyl acetate | 133778-23-1

• 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: methyl 4-<2-(1,1-dimethylethoxy)-2-oxethoxy>phenyl acetate
• 英文别名: Methyl 2-[4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]phenyl]acetate
• CAS: 133778-23-1
• 化学式: C₁₅H₂₀O₅
• 分子量: 280.321
• InChiKey: XDKPVOGRPYYCCU-UHFFFAOYSA-N

物化性质

• 沸点：
  360.4±22.0 °C(Predicted)
• 密度：
  1.111±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  20
• 可旋转键数：
  8
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  61.8
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  methyl 4-<2-(1,1-dimethylethoxy)-2-oxethoxy>phenyl acetate 、 N,N-bis(4-methoxybenzyl)ethenesulfonamide 在 18-冠醚-6 、 potassium carbonate 作用下， 以48%的产率得到
  参考文献：
  名称：

  Vinyl sulfonyl esters and amides in the synthesis of substituted .delta.-sultams and .delta.-sultones

  摘要：

  The Michael reaction of phenyl vinyl sulfonate (3) or vinyl sulfonamide 12 with phenylacetic esters was the key step in a general synthesis of 4-phenyl-substituted 1,2-thiazane, 1,1-dioxides (sultams) and 5-phenyl-1,2-oxathiane 1,1-dioxides (sultones). This methodology was applied to the synthesis of some cyclic sulfonamide and sulfonate derivatives (I and II) of the potent TXA2 receptor antagonists BM.13177 and BM.13505.

  DOI：

  10.1021/jo00011a020

文献信息

• [EN] HISTONE DEACETYLASE INHIBITORS AND METHODS OF USE THEREOF<br/>[FR] INHIBITEURS DE L'HISTONE DÉACÉTYLASE ET LEURS MÉTHODES D'UTILISATION
  申请人：DANA FARBER CANCER INST INC

  公开号：WO2012112447A9

  公开（公告）日：2012-10-18
• HISTONE DEACETYLASE INHIBITORS AND METHODS OF USE THEREOF
  申请人：Mazitschek Ralph

  公开号：US20140107166A1

  公开（公告）日：2014-04-17

  The present invention provides novel compounds for inhibiting histone deacetylases, and pharmaceutically acceptable salts and derivatives thereof. The present invention further provides methods for treating disorders regulated by histone deacetylase activity (e.g., proliferative diseases, cancer, inflammatory diseases, protozoal infections, hair loss, etc.) comprising administering a therapeutically effective amount of a compound of the invention to a subject in need thereof. The present invention also provides methods for preparing compounds of the invention.
• Vinyl sulfonyl esters and amides in the synthesis of substituted .delta.-sultams and .delta.-sultones
  作者：Joel Morris、Donn G. Wishka

  DOI：10.1021/jo00011a020

  日期：1991.5

  The Michael reaction of phenyl vinyl sulfonate (3) or vinyl sulfonamide 12 with phenylacetic esters was the key step in a general synthesis of 4-phenyl-substituted 1,2-thiazane, 1,1-dioxides (sultams) and 5-phenyl-1,2-oxathiane 1,1-dioxides (sultones). This methodology was applied to the synthesis of some cyclic sulfonamide and sulfonate derivatives (I and II) of the potent TXA2 receptor antagonists BM.13177 and BM.13505.