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5-ethenyl-2-nitrophenyl methyl ether | 883901-80-2

中文名称
——
中文别名
——
英文名称
5-ethenyl-2-nitrophenyl methyl ether
英文别名
2-methoxy-1-nitro-4-vinyl-benzene;2-Methoxy-1-nitro-4-vinylbenzene;4-ethenyl-2-methoxy-1-nitrobenzene
5-ethenyl-2-nitrophenyl methyl ether化学式
CAS
883901-80-2
化学式
C9H9NO3
mdl
——
分子量
179.175
InChiKey
IOQXLSFKTQQPAO-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

物化性质

  • 沸点:
    274.7±20.0 °C(Predicted)
  • 密度:
    1.184±0.06 g/cm3(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    2.5
  • 重原子数:
    13
  • 可旋转键数:
    2
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.11
  • 拓扑面积:
    55
  • 氢给体数:
    0
  • 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
  • 下游产品
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

点击查看最新优质反应信息

文献信息

  • Imidazopyridine Kinase Inhibitors
    申请人:Kuntz Kevin
    公开号:US20080300242A1
    公开(公告)日:2008-12-04
    The present invention provides imidazopyridine compounds, compositions containing the same, as well as processes for the preparation and methods for their use as pharmaceutical agents.
    本发明提供了咪唑并吡啶化合物、含有该化合物的组合物,以及它们的制备方法和作为药物的使用方法。
  • [EN] HETEROCYCLIC COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR<br/>[FR] COMPOSES HETEROCYCLIQUES CONVENANT POUR TRAITER DES TROUBLES SENSIBLES A UNE MODULATION DU RECEPTEUR D3 DE LA DOPAMINE
    申请人:ABBOTT GMBH & CO KG
    公开号:WO2006040182A1
    公开(公告)日:2006-04-20
    The invention relates to compounds of the formula (I) wherein n is 0, 1 or 2; G is CH2 or CHR3; R1 is H, C,-C6-alkyl, C,-C6-alkyl substituted by C3-C6-cycloalkyl, Cl-C6-hydroxyalkyl, fluorinated C,-C6-alkyl, C3-C6-cycloalkyl, fluorinated C3-C6-cycloalkyl, C3-C6­ alkenyl, fluorinated C3-C6-alkenyl, formyl, acetyl or propionyl; R2, R3 and R4 are, independently of each other, H, methyl, fluoromethyl, difluoromethyl, or trifluoromethyl; A is phenylene, pyridylene, pyrimidylene, pyrazinylene, pyridazinylene or thiophenylene, which can be substituted by one ore more substituents selected from halogen, methyl, methoxy and CF3; E is NR5 or CH2, wherein R5 is H or C1 -C3-alkyl; Ar is a cyclic radical selected from the group consisting of phenyl, a 5- or 6- ­membered heteroaromatic radical comprising as ring members 1, 2 or 3 heteroatoms selected from N, O and S and a phenyl ring fused to a saturated or unsaturated 5- or 6-membered carbocyclic or heterocyclic ring, where the heterocyclic ring comprises as ring members 1, 2 or 3 heteroatoms selected from N, O and S and/or 1, 2 or 3 heteroatom-containing groups each independently selected from NR8, where R8 is H, C1-C4-alkyl, fluorinated C1-C4-alkyl, C1-C4­alkylcarbonyl or fluorinated C1-C4-alkylcarbonyl, and where the cyclic radical Ar may carry 1, 2 or 3 substituents Ra, wherein the variable Ra has the meanings given in the claims and in the description; and physiologically tolerated acid addition salts thereof. The invention also relates to the use of a compound of the formula I or a pharmaceutically acceptable salt thereof for preparing a pharmaceutical composition for the treatment of a medical disorder susceptible to treatment with a dopamine D3 receptor ligand.
    该发明涉及以下式(I)的化合物,其中n为0、1或2;G为CH2或CHR3;R1为H、C1-C6烷基、被C3-C6环烷基取代的C1-C6烷基、Cl-C6羟基烷基、氟化的C1-C6烷基、C3-C6环烷基、氟化的C3-C6环烷基、C3-C6烯基、氟化的C3-C6烯基、甲酰基、乙酰基或丙酰基;R2、R3和R4独立地为H、甲基、氟甲基、二氟甲基或三氟甲基;A为苯基、吡啶基、嘧啶基、吡嗪基、吡啶嗪基或噻吩基,可以被卤素、甲基、甲氧基和CF3等一个或多个取代基取代;E为NR5或CH2,其中R5为H或C1-C3烷基;Ar为从苯基、含有1、2或3个异原子N、O和S的5-或6-元杂环芳基、以及与饱和或不饱和的5-或6-元碳环或杂环融合的苯基环组成的环状基,其中杂环环包含1、2或3个异原子N、O和S和/或1、2或3个异原子含氮基团,每个基团独立地选择自NR8,其中R8为H、C1-C4烷基、氟化的C1-C4烷基、C1-C4烷基酰基或氟化的C1-C4烷基酰基,环状基Ar可以携带1、2或3个取代基Ra,其中变量Ra具有权利要求和描述中给出的含义;以及其生理上可耐受的酸盐。该发明还涉及使用式I的化合物或其药学上可接受的盐制备用于治疗易受多巴胺D3受体配体治疗的医疗紊乱的药物组合物。
  • Heterocyclic Compounds Suitable For Treating Disorders That Respond To Modulation Of The Dopamine D3 Receptor
    申请人:Drescher Karla
    公开号:US20080045493A1
    公开(公告)日:2008-02-21
    The invention relates to compounds of the formula (I) wherein n is 0, 1 or 2; G is CH 2 or CHR 3 ; R 1 is H, C 1 -C 6 -alkyl, C 1 -C 6 -alkyl substituted by C 3 -C 6 -cycloalkyl, C 1 -C 6 -hydroxyalkyl, fluorinated C 1 -C 6 -alkyl, C 3 -C 6 -cycloalkyl, fluorinated C 3 -C 6 -cycloalkyl, C 3 -C 6 -alkenyl, fluorinated C 3 -C 6 -alkenyl, formyl, acetyl or propionyl; R 2 , R 3 and R 4 are, independently of each other, H, methyl, fluoromethyl, difluoromethyl, or trifluoromethyl; A is phenylene, pyridylene, pyrimidylene, pyrazinylene, pyridazinylene or thiophenylene, which can be substituted by one or more substituents selected from halogen, methyl, methoxy and CF 3 ; E is NR 5 or CH 2 , wherein R 5 is H or C 1 -C 3 -alkyl; Ar is a cyclic radical selected from the group consisting of phenyl, a 5- or 6-membered heteroaromatic radical comprising as ring members 1, 2 or 3 heteroatoms selected from N, O and S and a phenyl ring fused to a saturated or unsaturated 5- or 6-membered carbocyclic or heterocyclic ring, where the heterocyclic ring comprises as ring members 1, 2 or 3 heteroatoms selected from N, O and S and/or 1, 2 or 3 heteroatom-containing groups each independently selected from NR 8 , where R 8 is H, C 1 -C 4 -alkyl, fluorinated C 1 -C 4 -alkyl, C 1 -C 4 -alkylcarbonyl or fluorinated C 1 -C 4 -alkylcarbonyl, and where the cyclic radical Ar may carry 1, 2 or 3 substituents R a , wherein the variable R a has the meanings given in the claims and in the description; and physiologically tolerated acid addition salts thereof. The invention also relates to the use of a compound of the formula I or a pharmaceutically acceptable salt thereof for preparing a pharmaceutical composition for the treatment of a medical disorder susceptible to treatment with a dopamine D3 receptor ligand.
    本发明涉及式(I)的化合物,其中n为0、1或2;G为CH2或CHR3;R1为H、C1-C6烷基、C1-C6烷基取代的C3-C6环烷基、C1-C6羟基烷基、氟代C1-C6烷基、C3-C6环烷基、氟代C3-C6环烷基、C3-C6烯基、氟代C3-C6烯基、甲酰基、乙酰基或丙酰基;R2、R3和R4独立地为H、甲基、氟甲基、二氟甲基或三氟甲基;A为苯基、吡啶基、嘧啶基、吡嗪基、吡啶嗪基或噻吩基,可以被一个或多个卤素、甲基、甲氧基和CF3等取代基所取代;E为NR5或CH2,其中R5为H或C1-C3烷基;Ar为从苯基、一个5-或6-成员的杂环芳基基团中选择的循环基团,该杂环芳基基团的环成员包括1、2或3个从N、O和S选择的杂原子和与饱和或不饱和的5-或6-成员碳环或杂环芳基团融合的苯基环,其中所述杂环芳基团包括1、2或3个从N、O和S选择的杂原子和/或1、2或3个从NR8选择的含杂原子基团,其中R8为H、C1-C4烷基、氟代C1-C4烷基、C1-C4烷基羰基或氟代C1-C4烷基羰基,且所述循环基团Ar可以携带1、2或3个取代基Ra,其中变量Ra的含义如权利要求和说明书中所给出;以及其生理耐受的酸加合盐。本发明还涉及使用式I的化合物或其药学上可接受的盐制备用于治疗易于用多巴胺D3受体配体治疗的医疗疾病的药物组合物的用途。
  • Heterocyclic compounds suitable for treating disorders that respond to modulation of the dopamine D3 receptor
    申请人:Abbott GmbH & Co. KG
    公开号:US07851463B2
    公开(公告)日:2010-12-14
    The invention relates to compounds of the formula (I). The invention also relates to the use of a compound of the formula I or a pharmaceutically acceptable salt thereof for preparing a pharmaceutical composition for the treatment of a medical disorder susceptible to treatment with a dopamine D3 receptor ligand. The invention also relates to the use of a compound of the formula I or a pharmaceutically acceptable salt thereof for preparing a pharmaceutical composition for the treatment of a medical disorder susceptible to treatment with a dopamine D3 receptor ligand.
    本发明涉及公式(I)的化合物。本发明还涉及使用公式I的化合物或其药学上可接受的盐来制备药物组合物,用于治疗易于用多巴胺D3受体配体治疗的医疗疾患。本发明还涉及使用公式I的化合物或其药学上可接受的盐来制备药物组合物,用于治疗易于用多巴胺D3受体配体治疗的医疗疾患。
  • HETEROCYCLIC COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR
    申请人:Drescher Karla
    公开号:US20110160176A1
    公开(公告)日:2011-06-30
    The invention relates to compounds of the formula (I) wherein n is 0, 1 or 2; G is CH 2 or CHR 3 ; R 1 is H, C,-C 6 -alkyl, C,-C 6 -alkyl substituted by C 3 -C 6 -cycloalkyl, C 1 -C 6 -hydroxyalkyl, fluorinated C,-C 6 -alkyl, C 3 -C 6 -cycloalkyl, fluorinated C 3 -C 6 -cycloalkyl, C 3 -C 6 alkenyl, fluorinated C 3 -C 6 -alkenyl, formyl, acetyl or propionyl; R 2 , R 3 and R 4 are, independently of each other, H, methyl, fluoromethyl, difluoromethyl, or trifluoromethyl; A is phenylene, pyridylene, pyrimidylene, pyrazinylene, pyridazinylene or thiophenylene, which can be substituted by one or more substituents selected from halogen, methyl, methoxy and CF 3 ; E is NR 5 or CH 2 , wherein R 5 is H or C 1 -C 3 -alkyl; Ar is a cyclic radical selected from the group consisting of phenyl, a 5- or 6-membered heteroaromatic radical comprising as ring members 1, 2 or 3 heteroatoms selected from N, O and S and a phenyl ring fused to a saturated or unsaturated 5- or 6-membered carbocyclic or heterocyclic ring, where the heterocyclic ring comprises as ring members 1, 2 or 3 heteroatoms selected from N, O and S and/or 1, 2 or 3 heteroatom-containing groups each independently selected from NR 8 , where R 8 is H, C 1 -C 4 -alkyl, fluorinated C 1 -C 4 -alkyl, C 1 -C 4 alkylcarbonyl or fluorinated C 1 -C 4 -alkylcarbonyl, and where the cyclic radical Ar may carry 1, 2 or 3 substituents R a , wherein the variable R a has the meanings given in the claims and in the description; and physiologically tolerated acid addition salts thereof. The invention also relates to the use of a compound of the formula I or a pharmaceutically acceptable salt thereof for preparing a pharmaceutical composition for the treatment of a medical disorder susceptible to treatment with a dopamine D3 receptor ligand.
    本发明涉及公式(I)化合物,其中n为0,1或2;G为CH2或CHR3;R1为H,C,-C6-烷基,C,-C6-烷基被C3-C6-环烷基,C1-C6-羟基烷基,氟代C,-C6-烷基,C3-C6-环烷基,氟代C3-C6-环烷基,C3-C6-烯基,氟代C3-C6-烯基,甲酰基,乙酰基或丙酰基取代;R2,R3和R4分别为H,甲基,氟甲基,二氟甲基或三氟甲基;A为苯基,吡啶基,嘧啶基,吡嗪基,吡嗪啉基或噻吩基,可以被一个或多个卤素,甲基,甲氧基和CF3等取代基所取代;E为NR5或CH2,其中R5为H或C1-C3-烷基;Ar为从苯基,一个5-或6-成员的杂环芳基基团,包括由1、2或3个从N、O和S中选择的杂原子作为环成员和与饱和或不饱和的5-或6-成员的碳环或杂环的苯环融合的杂环,其中杂环包含作为环成员的1、2或3个从N、O和S中选择的杂原子和/或1、2或3个杂原子含有的基团,每个基团独立地从NR8中选择,其中R8为H,C1-C4-烷基,氟代C1-C4-烷基,C1-C4-烷基羰基或氟代C1-C4-烷基羰基,其中环状基团Ar可以携带1、2或3个取代基Ra,其中变量Ra在权利要求和说明中给出其含义;以及其生理耐受的酸加盐。本发明还涉及使用公式I化合物或其药学上可接受的盐制备用于治疗可用多巴胺D3受体配体治疗的医学疾病的药物组合物。
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