2-(1,2,3,4-Tetrahydroquinolin-3-yl)acetic acid | 933756-68-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 2-(1,2,3,4-Tetrahydroquinolin-3-yl)acetic acid
• CAS: 933756-68-4
• 化学式: C₁₁H₁₃NO₂
• 分子量: 191.23
• InChiKey: CIHMGVKHCUOVAG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  49.3
• 氢给体数：
  2
• 氢受体数：
  3

文献信息

• Biocatalyzed synthesis of the optically pure (R) and (S) 3-methyl-1,2,3,4-tetrahydroquinoline and their use as chiral synthons for the preparation of the antithrombic (21R)- and (21S)-argatroban
  申请人：Euticals S.P.A.

  公开号：US20160122303A1

  公开（公告）日：2016-05-05

  The present invention relates to the biocatalyzed synthesis of enantiomerically pure (3R) and (3S)-methyl-1,2,3,4-tetrahydroquinoline. Said enantiomerically pure compounds are useful as chiral synthons in organic synthesis and, in particular, for the preparation of diastereomerically pure (21R) and (21S)-agratroban and its analogues. New compounds used as intermediates in the process of the invention are also disclosed.

  本发明涉及生物催化合成对映纯的(3R)和(3S)-甲基-1,2,3,4-四氢喹啉。所述对映纯化合物在有机合成中作为手性合成物起到有用作用，特别是用于制备对映异构体纯的(21R)和(21S)-阿格曲班及其类似物。本发明还公开了作为中间体在该过程中使用的新化合物。
• Biocatalyzed synthesis of the optically pure (R) and (S) 3-methyl-1,2,3,4-tetrahydroquinoline and their use as chiral synthons for the preparation of the antithrombotic (21R)- and (21S)-argatroban
  申请人：Euticals S.P.A.

  公开号：EP2824187A1

  公开（公告）日：2015-01-14

  The present invention relates to the biocatalyzed synthesis of enantiomerically pure (3R) and (3S)-methyl-1,2,3,4-tetrahydroquinoline. Said enantiomerically pure compounds are useful as chiral synthons in organic synthesis and, in particular, for the preparation of diastereomerically pure (21 R) and (21 S)-agratroban and its analogues. New compounds used as intermediates in the process of the invention are also disclosed.

  本发明涉及生物催化合成对映体纯的(3R)和(3S)-甲基-1,2,3,4-四氢喹啉。上述对映体纯化合物可用作有机合成中的手性合成子，特别是用于制备非对映纯的（21 R）和（21 S）-阿曲洛班及其类似物。此外，还公开了在本发明工艺中用作中间体的新化合物。
• AMINE COMPOUNDS, THEIR PRODUCTION AND THEIR USE AS SOMATOSTATIN RECEPTOR ANTAGONISTS OR AGONISTS
  申请人：Takeda Chemical Industries, Ltd.

  公开号：EP1070054A1

  公开（公告）日：2001-01-24
• BIOCATALYZED SYNTHESIS OF THE OPTICALLY PURE (R) AND (S) 3-METHYL-1,2,3,4-TETRAHYDROQUINOLINE AND THEIR USE AS CHIRAL SYNTHONS FOR THE PREPARATION OF THE ANTITHROMBOTIC (21R)- AND (21S)-ARGATROBAN
  申请人：Euticals S.P.A.

  公开号：EP3019623B1

  公开（公告）日：2018-11-28
• US9630923B2
  申请人：——

  公开号：US9630923B2

  公开（公告）日：2017-04-25