benzyl 4-(tert-butoxycarbonylamino)-5-oxo-5-(N-(2-oxo-1-phenylpiperidin-3-yl)phenylsuIfonamido)pentanoate | 1259536-39-4

• 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: benzyl 4-(tert-butoxycarbonylamino)-5-oxo-5-(N-(2-oxo-1-phenylpiperidin-3-yl)phenylsuIfonamido)pentanoate
• 英文别名: benzyl 4-(tert-butoxycarbonylamino)-5-oxo-5-(N-(2-oxo-1-phenylpiperidin-3-yl)phenylsulfonamido)pentanoate；benzyl 5-[benzenesulfonyl-(2-oxo-1-phenylpiperidin-3-yl)amino]-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoate
• CAS: 1259536-39-4
• 化学式: C₃₄H₃₉N₃O₈S
• 分子量: 649.765
• InChiKey: FJDHRDYBWYCJFQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  46
• 可旋转键数：
  14
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  148
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  5-(苄氧基)-2-({[(2-甲基-2-丙基)氧基]羰基}氨基)-5-氧代戊酸 在 sodium tetrahydroborate 、 sodium hydride 、 三乙胺 、 N,N'-二环己基碳二亚胺 、 calcium chloride 、 lithium diisopropyl amide 作用下， 以 四氢呋喃 、 乙醇 、 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 19.16h， 生成 benzyl 4-(tert-butoxycarbonylamino)-5-oxo-5-(N-(2-oxo-1-phenylpiperidin-3-yl)phenylsuIfonamido)pentanoate
  参考文献：
  名称：

  LIBRARIES OF N-(2-OXO-1-PHENYLPIPERIDIN-3-YL)SULFONAMIDES FOR DRUG DISCOVERY

  摘要：

  小说化合物不断被寻求以治疗和预防疾病。该发明涉及对N-(2-氧代-1-苯基哌啶-3-基)磺酰胺的使用，有助于寻找和识别可以调节生物靶点功能活性的新领先化合物。

  公开号：

  US20120129888A1

文献信息

• N-(2-OXO-1-PHENYLPIPERIDIN-3-YL)SULFONAMIDES FOR THE IDENTIFICATION OF BIOLOGICAL AND PHARMACOLOGICAL ACTIVITY
  申请人：CASTELLS BOLIART Josep

  公开号：US20120142930A1

  公开（公告）日：2012-06-07

  Novel compounds are continually sought after to treat and prevent diseases and disorders. The invention relates to N-(2-oxo-1-phenylpiperidin-3-yl)sulfonamides useful for being biologically and pharmacologically screened, and to contribute to the exploration and identification of new lead molecules that are capable of modulating the functional activity of a biological target.

  小说化合物不断被寻求用于治疗和预防疾病和紊乱。该发明涉及对N-(2-氧代-1-苯基哌啶-3-基)磺酰胺的生物和药理筛选，以及对探索和识别能够调节生物靶标功能活性的新领先分子的贡献。
• [EN] N-(2-OXO-1-PHENYLPIPERIDIN-3-YL) SULFONAMIDES FOR THE IDENTIFICATION OF BIOLOGICAL AND PHARMACOLOGICAL ACTIVITY<br/>[FR] N-(2-OXO-1-PHÉNYLPIPÉRIDIN-3-YL)SULFONAMIDES POUR L'IDENTIFICATION D'UNE ACTIVITÉ BIOLOGIQUE ET PHARMACOLOGIQUE
  申请人：INST UNIV CIENCIA I TECNOLOGIA

  公开号：WO2010150204A1

  公开（公告）日：2010-12-29

  Novel compounds are continually sought after to treat and prevent diseases and disorders. The invention relates to N-(2-oxo-1-phenylpiperidin-3-yl) sulfonamides useful for being biologically and pharmacologically screened, and to contribute to the exploration and identification of new lead molecules that are capable of modulating the functional activity of a biological target.

  小说化合物不断被寻求用于治疗和预防疾病和疾病。该发明涉及对N-(2-氧代-1-苯基哌啶-3-基)磺胺类化合物的生物学和药理筛选，以及为探索和识别能够调节生物靶标功能活性的新引物分子而做出贡献。
• LIBRARIES OF N-(2-OXO-1-PHENYLPIPERIDIN-3-YL)SULFONAMIDES FOR THE IDENTIFICATION OF BIOLOGICAL AND PHARMACOLOGICAL ACTIVITY
  申请人：CASTELLS BOLIART JOSEP

  公开号：US20120122708A1

  公开（公告）日：2012-05-17

  New compounds are continually sought after for the treatment and prevention of disorders. The invention relates to N-(2-oxo-1-phenylpiperidin-3-yl)sulfonamides which can be biologically and pharmacologically traced, in order to be used in the search for, and identification of, new lead compounds that can modulate the functional activity of a biological target.

  不断寻找治疗和预防疾病的新化合物。该发明涉及N-(2-氧代-1-苯基哌啶-3-基)磺酰胺，可以在生物和药理学上追踪，以用于寻找和识别可以调节生物靶点的功能活性的新领先化合物。
• N-(1-PHENYL-2-OXO-3-PIPERIDYL SULPHONAMIDE LIBRARIES FOR DRUG DISCOVERY
  申请人：Institut Univ. de Ciència i Tecnologia, S.A.

  公开号：EP2447251A1

  公开（公告）日：2012-05-02

  Novel compounds are continually sought after to treat and prevent disorders. The invention relates to N-(2-oxo-1-phenylpiperidin-3-yl)sulfonamides useful for contributing to the search and identification of new lead compounds which can modulate the functional activity of a biological target.

  人们一直在寻找新的化合物来治疗和预防疾病。本发明涉及 N-(2-氧代-1-苯基哌啶-3-基)磺酰胺，有助于寻找和鉴定可调节生物靶标功能活性的新先导化合物。
• N-(1-PHENYL-2-OXO-3-PIPERIDYL)SULPHONAMIDE LIBRARIES FOR THE IDENTIFICATION OF BIOLOGICAL AND PHARMACOLOGICAL ACTIVITY
  申请人：Institut Univ. de Ciència i Tecnologia, S.A.

  公开号：EP2450349A1

  公开（公告）日：2012-05-09

  New compounds are continually sought after for the treatment and prevention of disorders. The invention relates to N-(2-oxo-1-phenylpiperidin-3-yl)sulfonamides which can be biologically and pharmacologically traced, in order to be used in the search for, and identification of, new lead compounds that can modulate the functional activity of a biological target.

  人们一直在寻找新的化合物来治疗和预防疾病。本发明涉及 N-(2-氧代-1-苯基哌啶-3-基)磺酰胺，可对其进行生物学和药理学追踪，以用于寻找和鉴定可调节生物靶标功能活性的新先导化合物。