N-[5-(2-chloro-1,3-oxazol-5-yl)-4-methyl-1,3-thiazol-2-yl]acetamide | 1415569-83-3

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: N-[5-(2-chloro-1,3-oxazol-5-yl)-4-methyl-1,3-thiazol-2-yl]acetamide
• CAS: 1415569-83-3
• 化学式: C₉H₈ClN₃O₂S
• 分子量: 257.7
• InChiKey: JVXJRHMKNNUVDW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  96.3
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  3-羟基吡啶 、 N-[5-(2-chloro-1,3-oxazol-5-yl)-4-methyl-1,3-thiazol-2-yl]acetamide 在 potassium carbonate 作用下， 以 二甲基亚砜 为溶剂， 以26%的产率得到N-[4-methyl-5-(2-pyridin-3-yloxy-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]acetamide
  参考文献：
  名称：

  Discovery and optimization of a series of 2-aminothiazole-oxazoles as potent phosphoinositide 3-kinase γ inhibitors

  摘要：

  A novel series of 2-aminothiazole-oxazoles was designed and synthesized as part of efforts to develop potent phosphoinositide 3-kinase gamma (PI3K gamma) inhibitors. The modification of a high-throughput screening hit, compound 1, resulted in the identification of compounds 10 and 15, which displayed potent inhibitory activities in enzyme-based and cell-based assays. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.10.028
• 作为产物：
  描述：

  N-[4-methyl-5-(2-sulfanyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]acetamide 在 三氯氧磷 作用下， 以52%的产率得到N-[5-(2-chloro-1,3-oxazol-5-yl)-4-methyl-1,3-thiazol-2-yl]acetamide
  参考文献：
  名称：

  Discovery and optimization of a series of 2-aminothiazole-oxazoles as potent phosphoinositide 3-kinase γ inhibitors

  摘要：

  A novel series of 2-aminothiazole-oxazoles was designed and synthesized as part of efforts to develop potent phosphoinositide 3-kinase gamma (PI3K gamma) inhibitors. The modification of a high-throughput screening hit, compound 1, resulted in the identification of compounds 10 and 15, which displayed potent inhibitory activities in enzyme-based and cell-based assays. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.10.028

文献信息

• Discovery and optimization of a series of 2-aminothiazole-oxazoles as potent phosphoinositide 3-kinase γ inhibitors
  作者：Yusuke Oka、Tetsuya Yabuuchi、Yasuyuki Fujii、Hidenori Ohtake、Shunichi Wakahara、Kayo Matsumoto、Mayumi Endo、Yunoshin Tamura、Yoshinori Sekiguchi

  DOI：10.1016/j.bmcl.2012.10.028

  日期：2012.12

  A novel series of 2-aminothiazole-oxazoles was designed and synthesized as part of efforts to develop potent phosphoinositide 3-kinase gamma (PI3K gamma) inhibitors. The modification of a high-throughput screening hit, compound 1, resulted in the identification of compounds 10 and 15, which displayed potent inhibitory activities in enzyme-based and cell-based assays. (C) 2012 Elsevier Ltd. All rights reserved.