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3-(5-hydroxypentyl)-phenol

中文名称
——
中文别名
——
英文名称
3-(5-hydroxypentyl)-phenol
英文别名
3-(5-hydroxypentyl)phenol
3-(5-hydroxypentyl)-phenol化学式
CAS
——
化学式
C11H16O2
mdl
——
分子量
180.247
InChiKey
LCFUXJGLTBQAER-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):
    2.4
  • 重原子数:
    13
  • 可旋转键数:
    5
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.45
  • 拓扑面积:
    40.5
  • 氢给体数:
    2
  • 氢受体数:
    2

反应信息

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文献信息

  • Novel compounds and their use in medicine,as antidiabetic and hypolipidemic agents, process for their preparation and pharmaceutical compositions containing them
    申请人:Debnath Bhunia
    公开号:US20070093476A1
    公开(公告)日:2007-04-26
    The present invention relates to novel compounds of formula (I) and their pharmaceutically acceptable salts, wherein ring “Ar 1 ” represents a monocyclic or polycyclic aromatic or partially saturated aromatic polycyclic, which may optionally contain up to 3 heteroatoms selected from N, S or O. The said monocyclic or polycyclic ring may be unsubstituted or have up to 4 substituents which may be identical or different; m and n independently represents an integer from 0 to 6; A represents O, S or bond; Y is selected from (CH 2 ) p′ (CH 2 ) p B(CH 2 ) q′ (CH 2 ) r B(CH 2 ) p D(CH 2 ) p′ where p, q and r each independently represents an integer from 0 to 6; B and D independently represents S, O, NR 4 or a bond, with a proviso that when B and D represents hereto atom p is not zero; R 4 represents hydrogen, alkyl, alkenyl, —S(O) 2 —R 8 or —C(O)R 8 where R 8 is alkyl, alkoxy; R 5 and R 6 independently represents hydrogen, alkyl, cycloalkyl or alkoxy; R 5 and R 6 together may form 3-8 membered cyclic ring which may optionally contains one or two hereto atoms selected from O, S or N; R 7 represents hydrogen, optionally substituted groups selected form alkyl, cycloalkyl, alkenyl or alkynyl. The present invention also relates to a process for preparation of compounds of formula (I), to pharmaceutical compositions containing compounds of formula (I) and their use in particular as antidiabetic, hypolipidemic, antiobesity and hypocholesterolemic agents.
    本发明涉及公式(I)的新化合物及其药学上可接受的盐,其中环“Ar1”表示单环或多环芳香或部分饱和芳香多环,可选含有最多3个选自N、S或O的杂原子。所述的单环或多环环可以未取代或具有最多4个相同或不同的取代基;m和n分别表示0到6的整数;A表示O、S或键;Y选自(CH2)p′(CH2)pB(CH2)q′(CH2)rB(CH2)pD(CH2)p′,其中p、q和r各自独立地表示0到6的整数;B和D分别表示S、O、NR4或键,条件是当B和D表示杂原子时,p不为零;R4表示氢、烷基、烯基、—S(O)2—R8或—C(O)R8,其中R8为烷基、烷氧基;R5和R6各自独立地表示氢、烷基、环烷基或烷氧基;R5和R6可以一起形成3-8成员环,该环可以选择性地包含选自O、S或N的一个或两个杂原子;R7表示氢、可选地从烷基、环烷基、烯基或炔基中选择的取代基。本发明还涉及公式(I)化合物的制备方法,含有公式(I)化合物的制药组合物以及其作为抗糖尿病、降脂、抗肥胖和降胆固醇药物的应用。
  • Antiinflammatory/antiallergic compounds
    申请人:RORER INTERNATIONAL (OVERSEAS) INC. (a Delaware corporation)
    公开号:EP0110405A2
    公开(公告)日:1984-06-13
    Compounds of the structure: and pharmaceutically acceptable salts thereof, wherein R1 and R2 are independently hydrogen, alkyl, carboxy, alkanoyloxy, aroyloxy, carboxyalkyl, carbalkoxyalkyl, carbalkoxy, alkanoyl, formyl, nitrile, amino, aminoalkyl, alkylamino, carboxamide, halo, trihalomethyl, hydroxy, aryloxy, nitro, sulfamyl, thio, alkylthio, and R1 and R2 when taken together with the carbon atoms to which they are attached form a phenyl ring; R3 is O, OH, OR4, SH, SR4, NH, HNR4 or N(R4)2; and M is an integerfrom 0 to 10; wherein Z1 is O, S or NR4; R4 is H, alkyl, pyranyl or aryl; and R5 is H, alkyl orfluoro.
    结构的化合物: 及其药学上可接受的盐,其中 R1 和 R2 独立地为氢、烷基、羧基、烷酰氧基、酰氧基、羧基烷基、碳烷氧基烷基、碳烷氧基、烷酰基、甲酰基、腈基、氨基、氨基烷基、烷基氨基、羧酰胺、卤代、三卤甲基、羟基、芳氧基、硝基、氨基磺酰基、硫代、烷硫基,且 R1 和 R2 与它们所连接的碳原子一起形成苯环; R3 是 O、OH、OR4、SH、SR4、NH、HNR4 或 N(R4)2;M 是 0 至 10 的整数;其中 Z1 是 O、S 或 NR4;R4 是 H、烷基、吡喃基或芳基;R5 是 H、烷基或氟。
  • Anti-inflammatory/anti-allergic compounds
    申请人:RHONE-POULENC RORER PHARMACEUTICALS INC.
    公开号:EP0181568A2
    公开(公告)日:1986-05-21
    Compounds of the formula: and salts thereof, wherein Ar1 is a nitrogen, sulfur, oxygen heterocyclic ring or aromatic ring; Ar is a phenyl ring or a nitrogen, oxygen or sulfur heterocyclic ring; Ar and Ar1 may be fully substituted or less than fully substituted with H, CH3, lower alkyl, aryl, aralkyl, halo, hydroxy, lower alkoxy, CF3, carboxy, alkylcarboxy, arylcarboxy, alkylcarbalkoxy, alkanoyl, formyl, oxo, nitrilo, amino, aminoalkyl, alkylamine, carboxamide, aryloxy, nitro, sulfonyl, sulfonamide, thio, or alkylthio; X = -O(CHR1)n-, , -NR2(CHR1)n-alkylene of up to 2 carbon atoms in the principal chain and up to a total of 4 carbon atoms, Z is an alkylene chain containing up to 10 carbon atoms in the principal chain and a total of up to 12 carbon atoms and from 0 to 2 double bonds and the said alkylene chain may be attached to Ar through an oxygen, sulfur or amino nitrogen atom, and when n'=2, one of the R substituents may be halogen on an omega carbon of the alkylene chain Z; when n'=1, R is a substituent attached to one of the carbon atoms of Z selected from the group consisting of =0, OR3, SR3, N(R2)2 and R,, -COR4 and when n'=2 one R is previously defined and the additional R is a substituent attached to one of the carbon atoms of Z selected from the group consisting of =O, OR3, SRa, N(R2)2, -COR4, lactone and halo; R1 is H or CH3; R2 is H, lower alkyl, aryl or aralkyl; R3 is H, lower alkyl, lower alkanoyl, aryl, aralkyl or substituted aryl in which the substituent is halo, lower alkyl or lower alkoxy; R4 is OR2 or N(R2)2; n = 0 or 1; n' = 1 to 7; and n" = 0, 1 or 2. 2. A compound of the formula: and salts thereof, wherein Ar1 is quinolyl; Ar is a phenyl, pyridyl or quinolyl ring; X = -O(CHR1)n-, -, NR2(CHR1)n-, alkylene of up to 2 carbon atoms in the principal chain and up to a total of 4 carbon atoms,
    式化合物及其盐类 及其盐类,其中 Ar1 是氮、硫、氧杂环或芳香环; Ar 是苯环或氮、氧或硫杂环; Ar 和 Ar1 可被 H、CH3、低级烷基、芳基、芳烷基、卤代、羟基、低级烷氧基、CF3、羧基、烷基羧基、芳基羧基、烷基羧基、烷基烷氧基、烷酰基、甲酰基、氧代、氮代、氨基、氨基烷基、烷基胺、羧酰胺、芳氧基、硝基、磺酰基、磺酰胺、硫代或烷硫基完全取代或未完全取代; X = -O(CHR1)n-、 、-NR2(CHR1)n-主链上最多 2 个碳原子且总共最多 4 个碳原子的烯烃、 当 n'=2 时,R 取代基之一可以是位于亚烷基链 Z 的欧米伽碳上的卤素; 当 n'=1 时,R 是连接到 Z 的一个碳原子上的取代基,该取代基选自由 =0、OR3、SR3、N(R2)2 和 R、-COR4 组成的组,当 n'=2 时,一个 R 如前定义,另外一个 R 是连接到 Z 的一个碳原子上的取代基,该取代基选自由 =O、OR3、SRa、N(R2)2、-COR4、内酯和卤素组成的组; R1 是 H 或 CH3; R2 是 H、低级烷基、芳基或芳烷基; R3 是 H、低级烷基、低级烷酰基、芳基、芳烷基或取代芳基,其中取代基是卤素、低级烷基或低级烷氧基; R4 是 OR2 或 N(R2)2; n = 0 或 1 n' = 1 至 7;以及 n" = 0、1 或 2。 2.式中的化合物 及其盐类、 其中 Ar1 是喹啉基; Ar 是苯基、吡啶基或醌基环; X = -O(CHR1)n-、 -、NR2(CHR1)n-、主链上最多 2 个碳原子且总共最多 4 个碳原子的亚烷基、
  • NOVEL COMPOUNDS AND THEIR USE AS ANTIDIABETIC AND HYPOLIPIDEMIC AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM
    申请人:Dr. Reddy's Laboratories Ltd.
    公开号:EP1680397A2
    公开(公告)日:2006-07-19
  • US5412137A
    申请人:——
    公开号:US5412137A
    公开(公告)日:1995-05-02
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