N-(2,2-diethoxyethyl)-Z-glycine | 1379186-60-3

• 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: N-(2,2-diethoxyethyl)-Z-glycine
• 英文别名: 2-(2,2-Diethoxyethylamino)acetic acid
• CAS: 1379186-60-3
• 化学式: C₈H₁₇NO₄
• 分子量: 191.227
• InChiKey: NAGOCTURIJJTGA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.3
• 重原子数：
  13
• 可旋转键数：
  8
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  67.8
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  N-(2,2-diethoxyethyl)-Z-glycine 、 4-aminomethyl-1-benzyl-4-methanesulfonylaminopiperidine 以 水 、 乙酸乙酯 、 乙腈 为溶剂， 生成 1-benzyl-4-[N-[N-(2,2-diethoxyethyl)-Z-glycyl]aminomethyl]-4-methanesulfonylaminopiperidine
  参考文献：
  名称：

  Sulfonamide derivatives, processes for producing the same and utilization thereof

  摘要：

  本发明提供了一种由下式表示的化合物或其盐：其中R1是一个可选择取代的碳氢基团或可选择取代的杂环基团，环A是一个可选择取代的含氮双价杂环基团，X′是一个可选择取代的烷基链，Y是一个可选择取代的双价环基团，X是一个化学键或可选择取代的烷基链，Z是（1）一个可选择取代的氨基团，（2）一个可选择取代的亚胺基团或（3）一个可选择取代的含氮杂环基团，或其前体药物，具有激活凝血因子X抑制活性，并且可用作抗凝剂。

  公开号：

  US06403595B1

文献信息

• Sulfonamide derivatives, their production and use
  申请人：——

  公开号：US20020193382A1

  公开（公告）日：2002-12-19

  The present invention is to provide a compound or a salt thereof represented by the formula: 1 wherein R 1 is an optionally substituted hydrocarbon group or an optionally substituted heterocyclic group, the ring A is an optionally substituted divalent nitrogen-containing heterocyclic group, X′ is an optionally substituted alkylene chain, Y is an optionally substituted divalent cyclic group, X is a chemical bond or an optionally substituted alkylene chain, and Z is (1)an optionally substituted amino group, (2) an optionally substituted imidoyl group or (3) an optionally substituted nitrogen-containing heterocyclic group, or a pro-drug thereof, which have activated coagulation factor X inhibitory activity and which is useful as anti-coagulant.

  本发明提供了一种化合物或其盐，其化学式为1，其中R1是可选取代的烃基或可选取代的杂环基，环A是可选取代的含氮双价杂环基，X'是可选取代的烷基链，Y是可选取代的双价环状基团，X是化学键或可选取代的烷基链，Z是（1）可选取代的氨基，（2）可选取代的咪唑基或（3）可选取代的含氮杂环基团，或其前药，具有活化凝血因子X抑制活性，可用作抗凝剂。
• 2-Piperazinone compounds, their production and use
  申请人：Takeda Chemical Industries, Ltd.

  公开号：EP0529858A1

  公开（公告）日：1993-03-03

  The compounds of the formula wherein G stands for an amidino group or an optionally cyclic amino group, these being respectively optionally substituted; D stands for a spacer having 2 to 6 atomic chain optionally bonded through a hetero-atom and/or a 5- to 6-membered ring (provided that the 5- to 6-membered ring is, depending on its bonding position, counted as 2 to 3 atomic chains); R¹ stands for hydrogen, benzyl group or a lower alkyl group; R² and R³ independently stand for a residual group formed by removing -CH(NH₂)COOH from an α-amino acid, or R¹ and R² may form a 5- to 6-membered ring taken together with the adjacent N and C; X stands for hydrogen or an optionally substituted lower alkyl group; and Z stands for a group capable of forming an anion or a group convertible into an anion in a living body, or salts thereof and agents for inhibiting cell-adhesion, which are characterized by containing these compounds. The novel compounds and pharmaceutical agents are effective for prophylaxis and therapy of various diseases by controlling or inhibiting cell adhesion.

  式中的化合物 其中，G 代表脒基或任选环状氨基，它们分别被任选取代；D 代表具有 2 至 6 个原子链的间隔物，可任选通过杂原子和/或 5 至 6 元环结合（条件是 5 至 6 元环根据其结合位置可被视为 2 至 3 个原子链）；R¹ 代表氢、苄基或低级烷基；R²和R³分别代表通过从α-氨基酸中去除-CH(NH₂)COOH而形成的残基，或者R¹和R²可与相邻的N和C一起形成5-6元环；X代表氢或任选取代的低级烷基；Z代表能够在活体内形成阴离子的基团或可转化为阴离子的基团，或其盐类和抑制细胞粘附的药剂，其特征在于含有这些化合物。这些新型化合物和药剂通过控制或抑制细胞粘附，可有效预防和治疗各种疾病。
• SULFONAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND UTILIZATION THEREOF
  申请人：Takeda Chemical Industries, Ltd.

  公开号：EP1054005A1

  公开（公告）日：2000-11-22

  The present invention is to provide a compound or a salt thereof represented by the formula: wherein R1 is an optionally substituted hydrocarbon group or an optionally substituted heterocyclic group, the ring A is an optionally substituted divalent nitrogen-containing heterocyclic group, X' is an optionally substituted alkylene chain, Y is an optionally substituted divalent cyclic group, X is a chemical bond or an optionally substituted alkylene chain, and Z is (1)an optionally substituted amino group, (2) an optionally substituted imidoyl group or (3) an optionally substituted nitrogen-containing heterocyclic group, or a pro-drug thereof, which have activated coagulation factor X inhibitory activity and which is useful as anti-coagulant.

  本发明旨在提供一种由式表示的化合物或其盐： 其中 R1 是任选取代的烃基或任选取代的杂环基，环 A 是任选取代的二价含氮杂环基，X'是任选取代的亚烷基链，Y 是任选取代的二价环基、X是化学键或任选取代的亚烷基链，Z是(1)任选取代的氨基，(2)任选取代的亚胺酰基或(3)任选取代的含氮杂环基，或其原药，具有活化凝血因子X抑制活性，可用作抗凝剂。
• EP0529858B1
  申请人：——

  公开号：EP0529858B1

  公开（公告）日：1997-10-15
• US5294713A
  申请人：——

  公开号：US5294713A

  公开（公告）日：1994-03-15