N,2-dimethyl-4,5-dihydro-1H-imidazole-5-carboxamide

• 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-dimethyl-4,5-dihydro-1H-imidazole-5-carboxamide
• 化学式: C₆H₁₁N₃O
• 分子量: 141.17
• InChiKey: UDAFMJIYHZQFRZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.4
• 重原子数：
  10
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  53.5
• 氢给体数：
  2
• 氢受体数：
  2

文献信息

• Azoline compound and azole compound library and method for producing same
  申请人：Suga Hiroaki

  公开号：US10197567B2

  公开（公告）日：2019-02-05

  An object of the present invention is to provide a method of efficiently constructing a library abundant in diversity and also usable for screening of a compound that binds to a target substance having protease activity. The present invention provides a method of constructing an azoline compound library containing two or more azoline compounds having an azoline backbone introduced into at least one of Cys, Ser, Thr, and 2,3-diamino acid, and analogs thereof of Xaa0 of a peptide represented by the following formula (I): A-(Xaa0)n-B  (I) [wherein, m numbers of Xaa0s respectively represent arbitrary amino acids, at least one of which is an amino acid selected from the group consisting of Cys, Ser, Thr, and 2,3-diamino acid, and analogs thereof, m represents an inter selected from 2 to 40, and A and B each independently represent a peptide composed of from 0 to 100 amino acids].

  本发明的目的是提供一种有效构建多样性丰富的化合物库的方法，该化合物库还可用于筛选与具有蛋白酶活性的靶物质结合的化合物。 本发明提供了一种构建唑啉化合物文库的方法，该文库含有两种或两种以上的唑啉化合物，这些唑啉化合物具有引入 Cys、Ser、Thr 和 2,3-二氨基酸中至少一种的唑啉骨架，以及下式（I）代表的肽的 Xaa0 的类似物： A-(Xaa0)n-B (I) [其中，Xaa0s 的 m 个数分别代表任意氨基酸，其中至少一个是选自 Cys、Ser、Thr 和 2,3-二 氨基酸及其类似物组成的组的氨基酸，m 代表选自 2 至 40 的间隔，A 和 B 各自独立地代表由 0 至 100 个氨基酸组成的肽]。
• Method for producing compound containing heterocycle
  申请人：The University of Tokyo

  公开号：US10329558B2

  公开（公告）日：2019-06-25

  An object of the present invention is to provide a method of stably introducing a heterocycle into a substrate peptide by using an azoline backbone introducing enzyme. The present invention provides a method of introducing a heterocycle into a leader-sequence-free substrate peptide by using an azoline backbone introducing enzyme to which a leader sequence of the substrate has been bound.

  本发明的目的是提供一种利用偶氮啉骨架导入酶将杂环稳定导入底物肽的方法。 本发明提供了一种利用偶氮啉骨架导入酶将杂环导入无前导序列底物肽的方法，底物的前导序列已与偶氮啉骨架导入酶结合。
• Azoline Compound and Azole Compound Library and Method for Producing Same
  申请人：Suga Hiroaki

  公开号：US20140113830A1

  公开（公告）日：2014-04-24

  An object of the present invention is to provide a method of efficiently constructing a library abundant in diversity and also usable for screening of a compound that binds to a target substance having protease activity. The present invention provides a method of constructing an azoline compound library containing two or more azoline compounds having an azoline backbone introduced into at least one of Cys, Ser, Thr, and 2,3-diamino acid, and analogs thereof of Xaa 0 of a peptide represented by the following formula (I): A-(Xaa 0 ) n -B  (I) [wherein, m numbers of Xaa 0 s respectively represent arbitrary amino acids, at least one of which is an amino acid selected from the group consisting of Cys, Ser, Thr, and 2,3-diamino acid, and analogs thereof, m represents an inter selected from 2 to 40, and A and B each independently represent a peptide composed of from 0 to 100 amino acids].
• Method for Producing Compound Containing Heterocycle
  申请人：THE UNIVERSITY OF TOKYO

  公开号：US20160083719A1

  公开（公告）日：2016-03-24

  An object of the present invention is to provide a method of stably introducing a heterocycle into a substrate peptide by using an azoline backbone introducing enzyme. The present invention provides a method of introducing a heterocycle into a leader-sequence-free substrate peptide by using an azoline backbone introducing enzyme to which a leader sequence of the substrate has been bound.