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4-hydroxy-6-isopropylpyridazin-3(2H)-one | 1616378-79-0

中文名称
——
中文别名
——
英文名称
4-hydroxy-6-isopropylpyridazin-3(2H)-one
英文别名
4-hydroxy-6-isopropylpyridazine-3(2H)-one;6-Propan-2-yl-1,2-dihydropyridazine-3,4-dione
4-hydroxy-6-isopropylpyridazin-3(2H)-one化学式
CAS
1616378-79-0
化学式
C7H10N2O2
mdl
——
分子量
154.169
InChiKey
UPNFCKKKLKWKBP-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):
    0.8
  • 重原子数:
    11
  • 可旋转键数:
    1
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.43
  • 拓扑面积:
    58.2
  • 氢给体数:
    2
  • 氢受体数:
    3

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为产物:
    描述:
    3,4-bis(benzyloxy)-6-(prop-1-en-2-yl)pyridazine 在 palladium on activated charcoal 、 氢气 作用下, 以 乙醇 为溶剂, 生成 4-hydroxy-6-isopropylpyridazin-3(2H)-one
    参考文献:
    名称:
    [EN] PYRIDAZINONES AS DAAO ENZYME INHIBITORS
    [FR] PYRIDAZINONES À TITRE D'INHIBITEURS D'ENZYMES DAAO
    摘要:
    本发明提供了化合物(I)及其药用可接受的盐,其中R1和R2如规范中定义,以及它们的制备方法,含有它们的药物组合物以及它们在治疗中的用途。
    公开号:
    WO2014096757A1
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文献信息

  • CEPHEM COMPOUND HAVING PYRIDINIUM GROUP
    申请人:Nishitani Yasuhiro
    公开号:US20140114060A1
    公开(公告)日:2014-04-24
    The present invention provides a novel compound which has a broad antibacterial spectrum and particularly exhibits a high antibacterial activity on β-lactamase-producing gram-negative bacteria. Specifically provided are: a compound represented by formula (I) wherein the meaning of each symbol is as defined in the description, an amino-group-protected form of a type of the compound which has the amino group on a ring in a position-7 side chain, or a pharmaceutically acceptable salt of the compound or the amino-group-protected form; and a pharmaceutical composition containing the compound, the amino-group-protected form or the pharmaceutically acceptable salt.
    本发明提供了一种新型化合物,具有广泛的抗菌谱,特别对产β-内酰胺酶的革兰氏阴性细菌表现出高抗菌活性。具体提供的是:一种由式(I)表示的化合物,其中每个符号的含义如描述中定义的那样,一种在环上具有基团的化合物的保护形式,该化合物在位置-7侧链上具有基团,或者化合物或基团保护形式的药用可接受盐;以及含有该化合物、基团保护形式或药用可接受盐的药物组合物。
  • CEPHEM COMPOUND HAVING PSEUDO-CATECHOL GROUP
    申请人:Yamawaki Kenji
    公开号:US20130079319A1
    公开(公告)日:2013-03-28
    A compound of the formula: wherein X is —N═, —CH═, or the like; W is —CH 2 — or the like; U is —S— or the like; R 1 and R 2 are each independently hydrogen, halogen, optionally substituted lower alkyl, or the like; Q is a single bond or the like; R 3 is hydrogen or the like; Ring A is a 6-membered aromatic heterocyclic group having 1-3 nitrogen atoms; each R 4 is independently hydrogen, halogen, or the like; m is an integer from 0 to 2; G is —C(═O)— or the like; D is a single bond, —NH—, or the like; and E is a cyclic quaternary ammonium group, or an ester, a protected compound at the amino on the ring in the 7-side chain, a pharmaceutically acceptable salt, or a solvate thereof.
    该化合物的化学式为:其中X为—N═、—CH═或类似基团;W为—CH2—或类似基团;U为—S—或类似基团;R1和R2各自独立地为氢、卤素、选择性取代的低碳基或类似基团;Q为单键或类似键;R3为氢或类似基团;环A为一个6元芳香杂环基团,具有1-3个氮原子;每个R4独立地为氢、卤素或类似基团;m为0到2的整数;G为—C(═O)—或类似基团;D为单键、—NH—或类似基团;E为一个环状季基团,或者是在7侧链上的基处的酯、保护化合物、药学上可接受的盐或其溶剂化物。
  • PYRIDAZINONES AS DAAO ENZYME INHIBITORS
    申请人:TAKEDA PHARMACEUTICAL COMPANY LIMITED
    公开号:US20150329495A1
    公开(公告)日:2015-11-19
    The present invention provides compounds of formula (I) and pharmaceutically acceptable salts thereof, wherein R 1 and R 2 are as defined in the specification, processes for their preparation, pharmaceutical compositions containing them and their use in therapy.
    本发明提供式(I)的化合物及其药学上可接受的盐,其中R1和R2如规范中所定义,其制备过程,包含它们的制药组合物以及它们在治疗中的使用。
  • 2-SUBSTITUTED CEPHEM COMPOUNDS
    申请人:GLAXO GROUP LIMITED
    公开号:US20150299223A1
    公开(公告)日:2015-10-22
    The present invention relates to 2-substituted cephem compounds of Formula (I) having a quaternary ammonium group on the 3-side chain, preferably together with a cathechol group, or pharmaceutically acceptable salts thereof, which exhibit potent antimicrobial spectrum against a variety of bacteria including Gram negative bacteria and/or Gram positive bacteria, corresponding pharmaceutical compositions, methods of making, treatment methods for bacterial infections or uses thereof.
    本发明涉及具有第3侧链上季基团的2-取代头孢菌素化合物(I), 与儿茶酚基团一起更佳,或其药学上可接受的盐,对包括革兰氏阴性菌和/或革兰氏阳性菌在内的多种细菌具有强效的抗微生物谱,相应的制药组合物,制备方法,治疗细菌感染的方法或其用途。
  • 2 substituted cephem compounds
    申请人:Glaxo Group Limited
    公开号:US10174053B2
    公开(公告)日:2019-01-08
    The compounds of the subject invention are related to 2-substituted cephem compounds, which have a wide antimicrobial spectrum, in particular exhibit potent antimicrobial activity against beta-lactamase producing Gram negative bacteria, and pharmaceutical compositions comprising the same.
    本发明的化合物与 2-取代的头孢化合物有关,它们具有广泛的抗菌谱,特别是对β-内酰胺酶产生的革兰氏阴性菌具有强效抗菌活性,以及包含这些化合物的药物组合物。
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