3-benzylsulfanyl-2R-tetrahydropyran-4-yloxycarbonylaminopropionic acid | 294885-09-9

• 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: 3-benzylsulfanyl-2R-tetrahydropyran-4-yloxycarbonylaminopropionic acid
• 英文别名: (2R)-3-benzylsulfanyl-2-(oxan-4-yloxycarbonylamino)propanoic acid
• CAS: 294885-09-9
• 化学式: C₁₆H₂₁NO₅S
• 分子量: 339.412
• InChiKey: WDFXGWXTYFHGEW-AWEZNQCLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  23
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  110
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  四氢吡喃-4-醇 、 DSC 、 2-amino-3-(benzylthio)propionic acid 、 N-succinimidyl tetrahydro-4H-pyran-4-yl carbonate 在 三乙胺 作用下， 以 二氯甲烷 、 乙酸乙酯 、 乙腈 为溶剂， 生成 3-benzylsulfanyl-2R-tetrahydropyran-4-yloxycarbonylaminopropionic acid
  参考文献：
  名称：

  Compounds and compositions as protease inhibitors

  摘要：

  这项发明涉及新型的巯基蛋白酶抑制剂，即烷酰基取代的杂环衍生物；它们的药用盐和N-氧化物；它们作为治疗剂的用途以及它们的制备方法。

  公开号：

  US06576630B1

文献信息

• Novel Compounds and compositions as protease inhibitors
  申请人：Axys Pharmaceuticals, Inc.

  公开号：US20030232864A1

  公开（公告）日：2003-12-18

  The present invention relates to novel alkanoyl-substituted heterocyclic derivatives which are cysteine protease inhibitors; the pharmaceutically acceptable salts and N-oxides thereof; their uses as therapeutic agents and the methods of their making.

  本发明涉及新型的烷酰基取代的杂环衍生物，它们是半胱氨酸蛋白酶抑制剂；其药学上可接受的盐和N-氧化物；它们作为治疗剂的用途和制备方法。
• AMINE DERIVATIVES AS PROTEASE INHIBITORS
  申请人：AXYS PHARMACEUTICALS, INC.

  公开号：EP1161422A1

  公开（公告）日：2001-12-12
• US6576630B1
  申请人：——

  公开号：US6576630B1

  公开（公告）日：2003-06-10
• [EN] AMINE DERIVATIVES AS PROTEASE INHIBITORS<br/>[FR] DERIVES AMINE UTILISES COMME INHIBITEURS DE PROTEASE
  申请人：AXYS PHARM INC

  公开号：WO2000055144A1

  公开（公告）日：2000-09-21

  The present invention relates to novel alkanoyl-substituted heterocyclic derivatives which are cysteine protease inhibitors; the pharmaceutically acceptable salts and N-oxides thereof; their uses as therapeutic agents and the methods of their making; according to Formula (I) in which: A comprises a heteromonocyclic ring containing 5 to 6 ring member atoms or a fused heteropolycyclic ring system containing 8 to 14 ring member atoms, wherein each ring contains 5 to 7 ring member atoms, X1 is a ring member carbon atom and each ring member atom other than X1 is a carbon atom or a heteroatom, with the proviso that (i) at least one ring member atom is a heteroatom and (ii) when A is a heteromonocyclic radical containing 5 ring member atoms, no more than two of the ring member atoms comprising A are heteroatoms; n is 0, 1, 2 or 3; X1 is =C- or -CH-; X2 is a bond or a divalent group of Formula (a) or (b); R1 - R8 = as in the application.
• Compounds and compositions as protease inhibitors
  申请人：AXYS Pharmaceuticals, Inc.

  公开号：US06576630B1

  公开（公告）日：2003-06-10

  The present invention relates to novel alkanoyl-substituted heterocyclic derivatives which are cysteine protease inhibitors; the pharmaceutically acceptable salts and N-oxides thereof; their uses as therapeutic agents and the methods of their making.

  这项发明涉及新型的巯基蛋白酶抑制剂，即烷酰基取代的杂环衍生物；它们的药用盐和N-氧化物；它们作为治疗剂的用途以及它们的制备方法。