N-(3,3-diethoxypropyl)-4-fluorobenzamide | 1259399-16-0

• 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: N-(3,3-diethoxypropyl)-4-fluorobenzamide
• 英文别名: 3,3-bis(ethoxy)propylamine
• CAS: 1259399-16-0
• 化学式: C₁₄H₂₀FNO₃
• 分子量: 269.316
• InChiKey: VZKKGRHYQUSHJY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.34
• 重原子数：
  19.0
• 可旋转键数：
  8.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  47.56
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  N-(3,3-diethoxypropyl)-4-fluorobenzamide 在 水 、 溶剂黄146 作用下， 生成 (2-formylethyl)-4-fluorobenzamide
  参考文献：
  名称：

  N-{3-[(1,1-dioxido-1,2-benzothiazol-3-yl)(phenyl)amino]propyl}benzamide analogs as potent Kv1.3 inhibitors. Part 1

  摘要：

  We report the synthesis and in vitro activity of a series of novel N-{3-[(1,1-dioxido-1,2-benzothiazol-3-yl)(phenyl)amino]propyl}benzamide analogs. These analogs showed potent inhibitory activity against Kv1.3. Several compounds, including compound 8b, showed similar potency to the known Kv1.3 inhibitor PAP-1 when tested under the IonWorks patch clamp assay conditions. (C) 2010 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2010.09.132
• 作为产物：
  描述：

  1-氨基-3,3-二乙氧基丙烷 、 对氟苯甲酸 在 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 以29%的产率得到N-(3,3-diethoxypropyl)-4-fluorobenzamide
  参考文献：
  名称：

  Fluorine‐18 labeled aldehydes as prosthetic groups for oxime coupling with a FVIIa protein

  摘要：

  18F‐labeled aldehydes can be utilized for oxime coupling with chemically sensitive proteins, such as coagulation factor VII (FVII), if they are sufficiently reactive and can react in an aqueous solvent. New 18F‐labeled nonvolatile aldehyde prosthetic groups derived from [18F]F‐Py‐TFP and spirocyclic iodonium (III)ylide precursors for late stage 18F‐labeling were developed. These precursors were characterized, 18F‐labeled, and compared in reactivity for oxime coupling. Oxime coupling was performed on an amino‐oxy modified inhibited factor VII (FVIIai‐ONH2) in low concentration to prove the applicability of the proposed method.

  DOI：

  10.1002/jlcr.3900