2-amino-5-((iodoacetamido)methyl)pyrrolo<2,3-d>pyrimidin-4-one | 102977-23-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯并嘧啶类
• 英文名称: 2-amino-5-((iodoacetamido)methyl)pyrrolo<2,3-d>pyrimidin-4-one
• 英文别名: N-[(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)methyl]-2-iodoacetamide
• CAS: 102977-23-1
• 化学式: C₉H₁₀IN₅O₂
• 分子量: 347.115
• InChiKey: KQSWODDYRBODRG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  112
• 氢给体数：
  4
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  7-aminomethyl-7-deazaguanine 生成 2-amino-5-((iodoacetamido)methyl)pyrrolo<2,3-d>pyrimidin-4-one
  参考文献：
  名称：

  NISIMURA, CYCYMY;HOMYPA, XIROO;AKIMOTO, XIROSI

  摘要：

  DOI：

文献信息

• Queuine analogs. Their synthesis and inhibition of growth of mouse L5178Y cells in vitro
  作者：Hiroshi Akimoto、Hiroaki Nomura、Mitsuzi Yoshida、Nobuko Shindo-Okada、Akio Hoshi、Susumu Nishimura

  DOI：10.1021/jm00159a031

  日期：1986.9

  A variety of analogues of queuine (7-[(3S,4R,5S)-4,5-dihydroxycyclopent-1-en-3-ylaminomethyl]- 7 -deazaguanine), i.e., those with 7-N-substituted aminomethyl side chains and those in which the oxygen function at the 6 position of the 7-deazaguanine ring was replaced by sulfur, were synthesized and tested for ability to act as substrates for tRNA-guanine transglycosylase and for inhibitory effects on growth of mouse L5178Y leukemic cells in vitro. Of the compounds tested, analogues with sulfur at the 6 position of the 7-deazaguanine ring in place of oxygen or with an N-o-hydroxyphenyl, N-m-hydroxyphenyl, or iodoacetyl group in the 7-aminomethyl side chain in place of the naturally occurring cyclopentene diol moiety markedly inhibited the growth of cells at concentrations of 1-10 micrograms/mL, although queuine itself had practically no effect at a concentration of 100 micrograms/mL.
• NISIMURA, CYCYMY;HOMYPA, XIROO;AKIMOTO, XIROSI
  作者：NISIMURA, CYCYMY、HOMYPA, XIROO、AKIMOTO, XIROSI

  DOI：——

  日期：——