2-[(3-amino-benzenesulfonyl)-carbamoylmethyl-amino]acetamide | 197367-35-4

• 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: 2-[(3-amino-benzenesulfonyl)-carbamoylmethyl-amino]acetamide
• 英文别名: 2-[(2-Amino-2-oxoethyl)-(3-aminophenyl)sulfonylamino]acetamide
• CAS: 197367-35-4
• 化学式: C₁₀H₁₄N₄O₄S
• 分子量: 286.312
• InChiKey: ULDACUNINIPFSQ-UHFFFAOYSA-N

物化性质

• 沸点：
  674.6±65.0 °C(Predicted)
• 密度：
  1.492±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -1.7
• 重原子数：
  19
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  158
• 氢给体数：
  3
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  2-[(3-amino-benzenesulfonyl)-carbamoylmethyl-amino]acetamide 以 phosphate buffer 、 二甲基亚砜 为溶剂， 反应 25.0h， 生成 2-[(3-{6-[3-(bis-carbamoylmethyl-sulfamoyl)-phenylamino]-2-chloro-pyrimidin-4-ylamino}-benzenesulfonyl)-carbamoylmethyl-amino]-acetamide
  参考文献：
  名称：

  Pyrimidine containing RSV fusion inhibitors

  摘要：

  The knowledge of SAR in a series of biphenyl anionic RSV inhibitors has been broadened by synthesis and testing of analogs with pyrimidine linkers. Generally, pyrimidine compounds were much harder to synthesize, and their anti-RSV activity was lower in comparison with triazine analogs. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.10.056
• 作为产物：
  描述：

  3-硝基苯磺酰氯 在 铁粉 、 sodium hydride 、 碳酸氢钠 、 溶剂黄146 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 2-[(3-amino-benzenesulfonyl)-carbamoylmethyl-amino]acetamide
  参考文献：
  名称：

  The discovery of RFI-641 as a potent and selective inhibitor of the respiratory syncytial virus

  摘要：

  The design and synthesis of a new potent and selective inhibitor of the respiratory syncytial virus are described. This compound, RFI-641, emerged From analysis of the structure-activity relationship in a series of biphenyl triazine anionic compounds possessing specific anti-RSV activity. The key synthetic step involves coupling of diaminobiphenyl 11 with two equivalents of chlorotriazine 10 under microwave conditions. RFI-641 inhibited RSV in vitro and in vivo models. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00150-0

文献信息

• Preparation and purification of antiviral disulfonic acid disodium salt
  申请人：American Home Products Corporation

  公开号：US20020151548A1

  公开（公告）日：2002-10-17

  The present invention provides a new process and intermediates for the production of antiviral compound 4′,4-bis-{4,6-bis-[3-(bis-carbamoyl-methyl-1-sulfamoyl)-phenylamino]-[1,3,5]triazin-2-ylamino}-biphenyl-2,2′-disulfonic acid and its pharmaceutically acceptable salts.

  本发明提供了一种用于制备抗病毒化合物4′，4-双[4,6-双(3-(双氨基甲酰基甲基-1-磺酰基)-苯基氨基)-[1,3,5]三嗪-2-基]联苯-2,2′-二磺酸及其药学上可接受的盐的新工艺和中间体。
• US6806366B2
  申请人：——

  公开号：US6806366B2

  公开（公告）日：2004-10-19
• US6960686B2
  申请人：——

  公开号：US6960686B2

  公开（公告）日：2005-11-01
• [EN] PREPARATION AND PURIFICATION OF ANTIVIRAL DISULFONIC ACID DISODIUM SALT<br/>[FR] PREPARATION ET PURIFICATION DE SEL DISODIQUE D'ACIDE SULFONIQUE ANTIVIRAL
  申请人：WYETH CORP

  公开号：WO2002062769A2

  公开（公告）日：2002-08-15

  The present invention provides a new process and intermediates for the production of antiviral compound 4',4-bis-4,6-bis-[bis-carbamoyl-methyl-1-sulfamoyl)phenylamino]-[1,3,5]triazin-2-ylamino}-biephenyl-2,2'-disulfonic acid and its pharmaceutically acceptable salts.
• The discovery of RFI-641 as a potent and selective inhibitor of the respiratory syncytial virus
  作者：Antonia A Nikitenko、Yuri E Raifeld、T.Z Wang

  DOI：10.1016/s0960-894x(01)00150-0

  日期：2001.4

  The design and synthesis of a new potent and selective inhibitor of the respiratory syncytial virus are described. This compound, RFI-641, emerged From analysis of the structure-activity relationship in a series of biphenyl triazine anionic compounds possessing specific anti-RSV activity. The key synthetic step involves coupling of diaminobiphenyl 11 with two equivalents of chlorotriazine 10 under microwave conditions. RFI-641 inhibited RSV in vitro and in vivo models. (C) 2001 Elsevier Science Ltd. All rights reserved.