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[(4,6-二氨基嘧啶-2-基)硫代]乙酸 | 6638-40-0

中文名称
[(4,6-二氨基嘧啶-2-基)硫代]乙酸
中文别名
——
英文名称
(4,6-diamino-pyrimidin-2-ylmercapto)-acetic acid
英文别名
(4,6-Diamino-pyrimidin-2-ylmercapto)-essigsaeure;2-((4,6-Diaminopyrimidin-2-yl)thio)acetic acid;2-(4,6-diaminopyrimidin-2-yl)sulfanylacetic acid
[(4,6-二氨基嘧啶-2-基)硫代]乙酸化学式
CAS
6638-40-0
化学式
C6H8N4O2S
mdl
MFCD02228572
分子量
200.221
InChiKey
JKAISOKGXPAILZ-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    -0.1
  • 重原子数:
    13
  • 可旋转键数:
    3
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.166
  • 拓扑面积:
    140
  • 氢给体数:
    3
  • 氢受体数:
    7

安全信息

  • 危险等级:
    IRRITANT
  • 危险品标志:
    Xi
  • 海关编码:
    2933599090

反应信息

点击查看最新优质反应信息

文献信息

  • Carboxymethylmercapto compounds as stabilizers for photographic emulsions
    申请人:EASTMAN KODAK CO
    公开号:US02819965A1
    公开(公告)日:1958-01-14

    The following heterocyclic mercapto compounds are heated in aqueous solution with sodium chloroacetate to give the corresponding carboxymethylmercapto-derivatives; 1-phenyl-2-imidazole-thione, 2-mercaptopyrimidine and its 4, 6-diamino-, 4, 5, 6-triamino, 4-amino-6-hydroxy or 4-hydroxy-6-methylderivatives, 2-mercaptobenzoxazole, 2-mercaptobenzthiazole, 3-phenyl (or amino)-4-amino-5-mercapto- 1, 2, 4-triazole, 3-mercapto-5-hydroxy (or phenyl) 6-methyl-1, 2, 4-triazine and 2-mercapto-imidazoline and its 4-methyl-derivative. 2-Carboxymethylmercapto- 4, 6-diamino-S-triazine is prepared by adding chloroacetic acid to a solution of 4, 6-diamino-2-mercapto-s-triazine in aqueous sodium hydroxide. 2-(1-Carboxyoctylmercapto)-4, 6-diamino-S-triazine is prepared by stirring a solution of a -bromopelargonic acid and 4, 6-diamino-2-mercapto-s-triazine in aqueous sodium hydroxide. 2-Carboxymethylmercapto-imidazoline chloroacetate is prepared by p boiling 2-mercapto-imidazoline and chloroacetic acid in water. Specifications 235,211 and 634,951 are referred to.

    以下杂环巯基化合物在水溶液中与氯乙酸钠加热,生成相应的羧甲基巯基衍生物;1-苯基-2-咪唑硫酮,2-巯基嘧啶及其4,6-二氨基-, 4,5,6-三氨基-, 4-氨基-6-羟基或4-羟基-6-甲基衍生物,2-巯基苯并噁唑,2-巯基苯并噻唑,3-苯基(或氨基)-4-氨基-5-巯基-1,2,4-三唑,3-巯基-5-羟基(或苯基)6-甲基-1,2,4-三嗪和2-巯基-咪唑啉及其4-甲基衍生物。通过将氯乙酸加入水溶性氢氧化钠中的2-巯基-4,6-二氨基-S-三嗪溶液制备2-羧甲基巯基-4,6-二氨基-S-三嗪。通过在水溶性氢氧化钠中搅拌溴辛酸和4,6-二氨基-2-巯基-S-三嗪的溶液制备2-(1-羧基辛基巯基)-4,6-二氨基-S-三嗪。通过在水中将2-巯基咪唑啉和氯乙酸反应制备2-羧甲基巯基-咪唑啉酸氯乙酸酯。参考规格235,211和634,951。
  • COMPOUNDS WITH HIV-1 INTEGRASE INHIBITORY ACTIVITY AND USE THEREOF AS ANTI-HIV/AIDS THERAPEUTICS
    申请人:Neamati Nouri
    公开号:US20090088420A1
    公开(公告)日:2009-04-02
    Pharmacophore models to be used in drug design and discovery are provided. An in silico protocol and in vitro assays are presented. Compounds and their pharmaceutically acceptable salts with HIV-1 integrase inhibitory and anti-HIV activity and use thereof in the treatment of HIV/AIDS and related infections either alone or in combination with all the known antiretroviral therapeutics are described.
  • US8183236B2
    申请人:——
    公开号:US8183236B2
    公开(公告)日:2012-05-22
  • Development of daptomycin for Gram-positive infections
    作者:F. P. Tally、M. F. DeBruin
    DOI:10.1093/jac/46.4.523
    日期:2000.10.1
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