ethyl 2-(3-hydroxy-2-((2-phenoxyacetyl)imino)-2,3-dihydrothiazol-4-yl)acetate | 1056652-19-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: ethyl 2-(3-hydroxy-2-((2-phenoxyacetyl)imino)-2,3-dihydrothiazol-4-yl)acetate
• CAS: 1056652-19-7
• 化学式: C₁₅H₁₆N₂O₅S
• 分子量: 336.368
• InChiKey: SDOALZVKPWDXMV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  23.0
• 可旋转键数：
  6.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  90.12
• 氢给体数：
  1.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  ethyl 2-(3-hydroxy-2-((2-phenoxyacetyl)imino)-2,3-dihydrothiazol-4-yl)acetate 在 sodium hydroxide 、 水 作用下， 以 四氢呋喃 为溶剂， 生成 2-(3-Hydroxy-2-(2-phenoxyacetamido)-2,3-dihydrothiazol-4-yl)acetic acid
  参考文献：
  名称：

  Discovery of novel hydroxy-thiazoles as HIF-α prolyl hydroxylase inhibitors: SAR, synthesis, and modeling evaluation

  摘要：

  Inhibition of the PHD2 enzyme has been associated with increased red blood cell levels. From a screening hit, a series of novel hydroxyl-thiazoles were developed as potent PHD2 inhibitors. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.06.031
• 作为产物：
  描述：

  Ethyl {2-[(phenoxyacetyl)amino]-1,3-thiazol-4-yl}acetate 在 Oxone 作用下， 以 甲醇 、 水 为溶剂， 生成 ethyl 2-(3-hydroxy-2-((2-phenoxyacetyl)imino)-2,3-dihydrothiazol-4-yl)acetate
  参考文献：
  名称：

  Discovery of novel hydroxy-thiazoles as HIF-α prolyl hydroxylase inhibitors: SAR, synthesis, and modeling evaluation

  摘要：

  Inhibition of the PHD2 enzyme has been associated with increased red blood cell levels. From a screening hit, a series of novel hydroxyl-thiazoles were developed as potent PHD2 inhibitors. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.06.031