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4,6-dimethylisoquinolin-3-amine | 1400701-55-4

中文名称
——
中文别名
——
英文名称
4,6-dimethylisoquinolin-3-amine
英文别名
——
4,6-dimethylisoquinolin-3-amine化学式
CAS
1400701-55-4
化学式
C11H12N2
mdl
——
分子量
172.23
InChiKey
XBXXYUFOSIHVCH-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):
    2.5
  • 重原子数:
    13
  • 可旋转键数:
    0
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.18
  • 拓扑面积:
    38.9
  • 氢给体数:
    1
  • 氢受体数:
    2

文献信息

  • [EN] SULFONAMIDE COMPOUNDS HAVING TRPM8 ANTAGONISTIC ACTIVITY<br/>[FR] COMPOSÉS SULFONAMIDES AYANT UNE ACTIVITÉ D'ANTAGONISTE DE TRPM8
    申请人:MITSUBISHI TANABE PHARMA CORP
    公开号:WO2012124825A1
    公开(公告)日:2012-09-20
    Sulfonamide compounds having TRPM8 antagonistic activity are provided. A sulfonamide compound of formula (I) or a pharmaceutically acceptable salt thereof, or a prodrug thereof: (I) wherein Ring A is bicyclic aromatic heterocycle comprised of (a) pyridine is condensed with benzene; or (b) pyridine is condensed with monocyclic aromatic heterocycle, and Ring A binds to a sulfonylamino moiety on a carbon atom adjacent to a nitrogen atom of the pyridine ring constituting Ring A, Ring B is (a) monocyclic or bicyclic aromatic hydrocarbon; (b) monocyclic or bicyclic alicyclic hydrocarbon; (c) monocyclic or bicyclic aromatic heterocycle; or (d) monocyclic or bicyclic non-aromatic heterocycle, Ring C is (a) benzene; or (b) monocyclic aromatic heterocycle, and other symbols are the same as defined in the specification.
    提供具有TRPM8拮抗活性的磺胺类化合物。公式(I)的磺胺类化合物或其药学上可接受的盐,或其前药:(I)其中环A是由(a)吡啶与苯环融合;或(b)吡啶与单环芳香杂环融合而成的双环芳香杂环,环A与构成环A的吡啶环上的氮原子相邻的碳原子上的磺酰基团结合,环B是(a)单环或双环芳香烃;(b)单环或双环脂环烃;(c)单环或双环芳香杂环;或(d)单环或双环非芳香杂环,环C是(a)苯环;或(b)单环芳香杂环,其他符号与规范中定义的相同。
  • [EN] 4-SUBSTITUTED AMINOISOQUINOLINE DERIVATIVES<br/>[FR] DÉRIVÉS D'AMINOISOQUINOLÉINE SUBSTITUÉS EN POSITION 4
    申请人:PURDUE RESEARCH FOUNDATION
    公开号:WO2018035072A1
    公开(公告)日:2018-02-22
    [00397] This invention relates to 4-substituted isoquinoline compounds and their derivatives and uses thereof for treatment of cancer, for example, acute myeloid leukemia.
    这项发明涉及4-取代异喹啉化合物及其衍生物,以及它们在癌症治疗中的用途,例如急性髓细胞白血病。
  • SULFONAMIDE COMPOUNDS HAVING TRPM8 ANTAGONISTIC ACTIVITY
    申请人:Tsuzuki Yasuyuki
    公开号:US20140005393A1
    公开(公告)日:2014-01-02
    Sulfonamide compounds having TRPM8 antagonistic activity are provided. A sulfonamide compound of formula (I) or a pharmaceutically acceptable salt thereof, or a prodrug thereof: (I) wherein Ring A is bicyclic aromatic heterocycle comprised of (a) pyridine is condensed with benzene; or (b) pyridine is condensed with monocyclic aromatic heterocycle, and Ring A binds to a sulfonylamino moiety on a carbon atom adjacent to a nitrogen atom of the pyridine ring constituting Ring A, Ring B is (a) monocyclic or bicyclic aromatic hydrocarbon; (b) monocyclic or bicyclic alicyclic hydrocarbon; (c) monocyclic or bicyclic aromatic heterocycle; or (d) monocyclic or bicyclic non-aromatic heterocycle, Ring C is (a) benzene; or (b) monocyclic aromatic heterocycle, and other symbols are the same as defined in the specification.
    提供具有TRPM8拮抗活性的磺胺类化合物。提供式(I)的磺胺类化合物或其药学上可接受的盐或前药,其中,环A是由(a)吡啶与苯环缩合;或(b)吡啶与单环芳杂环缩合构成的双环芳香杂环,环A与构成环A的吡啶环上的氮原子相邻的碳原子上的磺酰基团结合,环B为(a)单环或双环芳香烃;(b)单环或双环脂环烃;(c)单环或双环芳杂环;或(d)单环或双环非芳杂环,环C为(a)苯环;或(b)单环芳杂环,其他符号与规范中定义的相同。
  • SUBSTITUTED MONO- AND POLYAZANAPHTHALENE DERIVATIVES AND THEIR USE
    申请人:Basilea Pharmaceutica International AG
    公开号:US20180002321A1
    公开(公告)日:2018-01-04
    Disclosed are compounds of formula (I) wherein A is CH or N, B is CR or N; and D is CR; R represents hydrogen, OH or NH 2 ; R1 and R2, independently of each other, represent hydrogen, N(R3) 2 , halogen, cyano, nitro, R4-C1-C4alkyl, R4-C1-C4halogenoalkyl, OH, R4-C1-C4alkoxy, R4-C1-C4halogenoalkoxy, SH, R4-C1-C4alkythio, R4-C1-C4halogenoalkylthio; R3 represents, independently at each occurrence, hydrogen, R4-C1-C4alkyl or R4-C1-C4halogenoalkyl; R3a represents, independently at each occurrence, hydrogen or C1-C4 alkyl; R4 represents, independently at each occurrence, hydrogen, halogen, cyano, OH, SH, NH 2 , NH(CH 3 ) or N(CH 3 ) 2 ; X represents a group of formula -E- or -E-F—, wherein E and F are different from each other and represent a group selected from —C(R3a)2-, —(C═O)—, —NR3a- and —O— and F is linked to Y, with the proviso that if X represents -E-F— one of E or F represents —C(R3a) 2 - or —(C═O)—; Y represents a group selected from C1-C6alkyl, mono- or bicyclic C3-C11cycloalkyl, which may be partially unsaturated, mono- or bicyclic 3 to 11-membered heterocycloalkyl, which may be partially unsaturated, a mono- or bicyclic group comprising at least one aryl or heteroaryl cycle, wherein said heterocycloalkyl group and said group comprising at least one heteroaryl cycle comprise one or more heteroatoms selected from nitrogen, oxygen and sulfur and said group Y is either unsubstituted or substituted by one or more substituents and comprises including its substituents one or more than one nitrogen atom having a lone electron pair; and Z represents a mono- or bicyclic group comprising at least one aryl or heteroaryl cycle, said heteroaryl cycle comprising one or more heteroatoms selected from nitrogen, oxygen and sulfur, which aryl or heteroaryl group is unsubstituted or substituted by one or more substituents; including tautomers of said compounds, mixtures of two tautomeric forms of said compounds, and pharmaceutically acceptable salts of said compounds, tautomers thereof or mixtures of two tautomeric forms thereof, preferably with the proviso that Y comprises one or more primary amino group —NH 2 , when X represents —(C═O)— or —(C═O)—NR3a-, wherein R3a represents hydrogen or C1-C4alkyl; which are useful for the treatment of proliferation disorders or diseases, such as cancer.
  • US8987445B2
    申请人:——
    公开号:US8987445B2
    公开(公告)日:2015-03-24
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