(S)-5,5-dimethyl-2-(3-phenylmorpholino)-5,6-dihydrobenzo[d]thiazol-7(4H)-one | 1052208-78-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 恶嗪烷类
• 英文名称: (S)-5,5-dimethyl-2-(3-phenylmorpholino)-5,6-dihydrobenzo[d]thiazol-7(4H)-one
• 英文别名: 5,5-dimethyl-2-[(3S)-3-phenylmorpholin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one
• CAS: 1052208-78-2
• 化学式: C₁₉H₂₂N₂O₂S
• 分子量: 342.462
• InChiKey: IYWGYXFIYMCKHV-OAHLLOKOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  24
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  70.7
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  2-溴-5,5-二甲基-5,6-二氢-4H-苯并噻唑-7-酮 、 (S)-3-苯基吗啉 在 N,N-二异丙基乙胺 作用下， 以 异丙醇 为溶剂， 以12%的产率得到(S)-5,5-dimethyl-2-(3-phenylmorpholino)-5,6-dihydrobenzo[d]thiazol-7(4H)-one
  参考文献：
  名称：

  4-(1,3-Thiazol-2-yl)morpholine derivatives as inhibitors of phosphoinositide 3-kinase

  摘要：

  4-(1,3-Thiazol-2-yl)morpholine derivatives have been identified as potent and selective inhibitors of phosphoinositide 3-kinase. The SAR data of selected examples are presented and the in vivo pro. ling of compound 18 is shown to demonstrate the utility of this class of compounds in xenograft models of tumor growth. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.06.076

文献信息

• 4-(1,3-Thiazol-2-yl)morpholine derivatives as inhibitors of phosphoinositide 3-kinase
  作者：Rikki Alexander、Ahrani Balasundaram、Mark Batchelor、Daniel Brookings、Karen Crépy、Tom Crabbe、Marie-France Deltent、Frank Driessens、Andrew Gill、Sue Harris、Gillian Hutchinson、Claire Kulisa、Mark Merriman、Prakash Mistry、Ted Parton、James Turner、Ian Whitcombe、Sara Wright

  DOI：10.1016/j.bmcl.2008.06.076

  日期：2008.8

  4-(1,3-Thiazol-2-yl)morpholine derivatives have been identified as potent and selective inhibitors of phosphoinositide 3-kinase. The SAR data of selected examples are presented and the in vivo pro. ling of compound 18 is shown to demonstrate the utility of this class of compounds in xenograft models of tumor growth. (c) 2008 Elsevier Ltd. All rights reserved.