Tert-butyl 2-amino-4-fluoropent-4-enoate | 215716-71-5

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: Tert-butyl 2-amino-4-fluoropent-4-enoate
• CAS: 215716-71-5
• 化学式: C₉H₁₆FNO₂
• 分子量: 189.23
• InChiKey: CIKIRIDCKNPYQV-UHFFFAOYSA-N

物化性质

• 沸点：
  201.8±40.0 °C(Predicted)
• 密度：
  1.022±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  13
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  52.3
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  Tert-butyl 2-amino-4-fluoropent-4-enoate 在 盐酸 、 水 作用下， 反应 6.0h， 以73%的产率得到DL-asparagine
  参考文献：
  名称：

  3-Bromo-2-fluoropropene - A Fluorinated Building Block. 2-Fluoroallylation of Glycine and Alanine Ester Imines

  摘要：

  DOI：

  10.1055/s-1998-2174
• 作为产物：
  描述：

  tert-butyl 2-(benzhydrylideneamino)-4-fluoropent-4-enoate 在 水 、 三氟乙酸 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 4.0h， 以76%的产率得到Tert-butyl 2-amino-4-fluoropent-4-enoate
  参考文献：
  名称：

  3-Bromo-2-fluoropropene - A Fluorinated Building Block. 2-Fluoroallylation of Glycine and Alanine Ester Imines

  摘要：

  DOI：

  10.1055/s-1998-2174

文献信息

• Compounds with Matrix-Metalloproteinase Inhibitory Activity and Imaging Agents Thereof
  申请人：Kolb Hartmuth C.

  公开号：US20120282180A1

  公开（公告）日：2012-11-08

  The present invention relates to the field of therapeutic and diagnostic agents and more specifically to compounds of formula (I) that are inhibitors of matrix-metalloproteinases (MMPs) and are useful in the treatment of diseases related thereto such as cardiovascular diseases, inflammatory diseases and malignant diseases. One embodiment of the invention is a compound of formula (I) labeled with a 18-fluorine atom having matrix metalloproteinase inhibitory activity suitable for diagnostic imaging. Also disclosed in the present invention is a pharmaceutical composition comprising the inhibitors of matrix-metalloproteinases (MMPs) of the invention or the corresponding labeled compounds useful as diagnostic imaging agents of the invention in a form suitable for mammalian administration. The invention furthermore discloses intermediates in the synthesis of the inhibitors of matrix-metalloproteinases (MMPs) of the invention and of the diagnostic imaging agents of the invention and kits for the preparation of the pharmaceutical composition of the invention.

  本发明涉及治疗和诊断剂的领域，更具体地涉及式（I）化合物，它们是基质金属蛋白酶（MMPs）的抑制剂，可用于治疗与之相关的疾病，如心血管疾病、炎症性疾病和恶性疾病。本发明的一种实施例是一种带有18-氟原子的式（I）化合物，具有适用于诊断成像的基质金属蛋白酶抑制活性。本发明还揭示了一种制剂，其中包括本发明的基质金属蛋白酶抑制剂或相应的标记化合物，适用于哺乳动物给药的形式。此外，本发明还揭示了合成本发明的基质金属蛋白酶抑制剂和诊断成像剂的中间体，以及制备本发明的制剂的工具箱。
• Compounds with matrix-metalloproteinase inhibitory activity
  申请人：Westfälische Wilhelms-Universität Münster

  公开号：EP2520573A1

  公开（公告）日：2012-11-07

  The present invention relates to the field of therapeutic and diagnostic agents and more specifically to compounds of formula (I) that are inhibitors of matrix-metalloproteinases (MMPs) and are useful in the treatment of diseases related thereto such as cardiovascular diseases, inflammatory diseases and malignant diseases. One embodiment of the invention is a compound of formula (I) labeled with a 18-fluorine atom having matrix metalloproteinase inhibitory activity suitable for diagnostic imaging. Also disclosed in the present invention is a pharmaceutical composition comprising the inhibitors of matrix-metalloproteinases (MMPs) of the invention or the corresponding labeled compounds useful as diagnostic imaging agents of the invention in a form suitable for mammalian administration. The invention furthermore discloses intermediates in the synthesis of the inhibitors of matrix-metalloproteinases (MMPs) of the invention and of the diagnostic imaging agents of the invention and kits for the preparation of the pharmaceutical composition of the invention.

  本发明涉及治疗剂和诊断剂领域，更具体地说，涉及作为基质金属蛋白酶（MMPs）抑制剂的式(I)化合物，可用于治疗与之相关的疾病，如心血管疾病、炎症性疾病和恶性疾病。本发明的一个实施方案是用 18-氟原子标记的式 (I) 化合物，该化合物具有基质金属蛋白酶抑制活性，适用于诊断成像。本发明还公开了一种药物组合物，其包含本发明的基质金属蛋白酶（MMPs）抑制剂或相应的标记化合物，以适合哺乳动物给药的形式用作本发明的诊断成像剂。本发明还进一步公开了合成本发明基质金属蛋白酶（MMPs）抑制剂和本发明诊断成像剂的中间体以及制备本发明药物组合物的试剂盒。
• 3-Bromo-2-fluoropropene - A Fluorinated Building Block. 2-Fluoroallylation of Glycine and Alanine Ester Imines
  作者：Klaus W. Laue、Günter Haufe

  DOI：10.1055/s-1998-2174

  日期：1998.10