(2-{4-[Diisopropylamino-(4-methoxy-benzyloxy)-phosphanyloxy]-phenyl}-ethyl)-carbamic acid 9H-fluoren-9-ylmethyl ester | 208932-59-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 芴
• 英文名称: (2-{4-[Diisopropylamino-(4-methoxy-benzyloxy)-phosphanyloxy]-phenyl}-ethyl)-carbamic acid 9H-fluoren-9-ylmethyl ester
• 英文别名: 9H-fluoren-9-ylmethyl N-[2-[4-[[di(propan-2-yl)amino]-[(4-methoxyphenyl)methoxy]phosphanyl]oxyphenyl]ethyl]carbamate
• CAS: 208932-59-6
• 化学式: C₃₇H₄₃N₂O₅P
• 分子量: 626.733
• InChiKey: GCFFSJFPUNJEIX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.2
• 重原子数：
  45
• 可旋转键数：
  15
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  69.3
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  2-乙基丁醛 、 FMOC-(4-氨甲基)苯甲酸 、 (2-{4-[Diisopropylamino-(4-methoxy-benzyloxy)-phosphanyloxy]-phenyl}-ethyl)-carbamic acid 9H-fluoren-9-ylmethyl ester 生成 Phosphoric acid mono-{4-[2-(4-{[bis-(2-ethyl-butyl)-amino]-methyl}-benzoylamino)-ethyl]-phenyl} ester
  参考文献：
  名称：

  Novel phosphate ester-linked resins: The solid-phase generation of phenyl phosphate-containing compounds for SH2 inhibition

  摘要：

  An efficient method for the preparation of protected phosphate ester-linked resins in high yield and purity is presented. Variation in tether length/functionality and substitution pattern of the phenol precursors, as well as mild deprotection conditions make this system ideal for the combinatorial generation of phenyl phosphate SH2 inhibitor libraries. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(98)00586-3
• 作为产物：
  描述：

  双二异丙基氨基氯化磷 在 泛影酸 、 三乙胺 作用下， 以 乙醚 、 二氯甲烷 为溶剂， 反应 2.17h， 生成 (2-{4-[Diisopropylamino-(4-methoxy-benzyloxy)-phosphanyloxy]-phenyl}-ethyl)-carbamic acid 9H-fluoren-9-ylmethyl ester
  参考文献：
  名称：

  Novel phosphate ester-linked resins: The solid-phase generation of phenyl phosphate-containing compounds for SH2 inhibition

  摘要：

  An efficient method for the preparation of protected phosphate ester-linked resins in high yield and purity is presented. Variation in tether length/functionality and substitution pattern of the phenol precursors, as well as mild deprotection conditions make this system ideal for the combinatorial generation of phenyl phosphate SH2 inhibitor libraries. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(98)00586-3

文献信息

• Novel phosphate ester-linked resins: The solid-phase generation of phenyl phosphate-containing compounds for SH2 inhibition
  作者：Chester A. Metcalf、Chi B. Vu、Raji Sundaramoorthi、Virginia A. Jacobsen、Edgardo A. Laborde、Jeremy Green、Yinka Green、Karina J. Macek、Taylor J. Merry、Selvi G. Pradeepan、Mayumi Uesugi、Vaibhav M. Varkhedkar、Dennis A. Holt

  DOI：10.1016/s0040-4039(98)00586-3

  日期：1998.5

  An efficient method for the preparation of protected phosphate ester-linked resins in high yield and purity is presented. Variation in tether length/functionality and substitution pattern of the phenol precursors, as well as mild deprotection conditions make this system ideal for the combinatorial generation of phenyl phosphate SH2 inhibitor libraries. (C) 1998 Elsevier Science Ltd. All rights reserved.