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5-甲基-6,7-二氢-5H-环戊二烯并[b]吡啶 | 109942-11-2

中文名称
5-甲基-6,7-二氢-5H-环戊二烯并[b]吡啶
中文别名
——
英文名称
5-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
英文别名
5-Methyl-6.7-dihydro-1.5-pyrindan;5-methyl-6,7-dihydro-5H-[1]pyrindine
5-甲基-6,7-二氢-5H-环戊二烯并[b]吡啶化学式
CAS
109942-11-2
化学式
C9H11N
mdl
——
分子量
133.193
InChiKey
NYYIPACQAZRSHZ-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:
    201.1±9.0 °C(Predicted)
  • 密度:
    1.011±0.06 g/cm3(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    1.9
  • 重原子数:
    10
  • 可旋转键数:
    0
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.44
  • 拓扑面积:
    12.9
  • 氢给体数:
    0
  • 氢受体数:
    1

文献信息

  • OPTICALLY ACTIVE CROSSLINKED CYCLIC SECONDARY AMINE DERIVATIVE
    申请人:Sumitomo Dainippon Pharma Co., Ltd.
    公开号:US20210024547A1
    公开(公告)日:2021-01-28
    The present invention relates to the compound of formula (I) wherein p is 1 or 2, R 1 is —CF 3 or the like, R 2a , R 2b , R 3a , and R 3b are hydrogen atom or the like, X is —C(═O)—or the like, or a pharmaceutically acceptable salt thereof, which has an antitumor effect by inhibiting the binding between a MLL fusion protein that is infused with AF4, AF9, or the like, which is a representative fusion partner gene causing MLL leukemia, and menin.
    本发明涉及式(I)化合物,其中p为1或2,R1为—CF3或类似基团,R2a、R2b、R3a和R3b为氢原子或类似基团,X为—C(═O)—或类似基团,或其药学上可接受的盐。该化合物通过抑制与AF4、AF9或类似的代表性融合伴侣基因引起的MLL白血病的MLL融合蛋白与menin之间的结合而具有抗肿瘤效果。
  • 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS
    申请人:Aicher Thomas Daniel
    公开号:US20100105659A1
    公开(公告)日:2010-04-29
    Provided are compounds that are useful in the treatment and/or prevention of diseases mediated by deficient levels of glucokinase activity, such as diabetes mellitus. Also provided are methods of treating or preventing diseases and disorders characterized by underactivity of glucokinase or which can be treated by activating glucokinase.
    提供了一些化合物,这些化合物在治疗和/或预防由葡萄糖激酶活性不足引起的疾病中非常有用,例如糖尿病。同时提供了治疗或预防由葡萄糖激酶活性不足或可以通过激活葡萄糖激酶治疗的疾病和疾病的方法。
  • Pyridin-2YL-Amino-1, 2, 4-Thiadiazole Derivatives as Glucokinase Activators for the Treatment of Diabetes Mellitus
    申请人:AICHER Thomas Daniel
    公开号:US20120277242A1
    公开(公告)日:2012-11-01
    Provided are compounds of Formula (I): wherein R 2 , R 3 , R 13 , L and D 2 are as defined in the specification, which are useful in the treatment and/or prevention of diseases or disorders mediated by deficient levels of glucokinase activity or which can be treated by activating glucokinase including, but not limited to, diabetes mellitus, impaired glucose tolerance, IFG (impaired fasting glucose) and IFG (impaired fasting glycemia), as well as other diseases and disorders such as those discussed herein.
    本发明提供了式(I)的化合物:其中R2、R3、R13、L和D2如规范中所定义,它们在治疗和/或预防由葡萄糖激酶活性不足介导的疾病或疾病中有用,或者可以通过激活葡萄糖激酶来治疗,包括但不限于糖尿病、糖耐量受损、IFG(空腹血糖受损)和IFG(空腹高血糖),以及其他疾病和疾病,如在此处所讨论的。
  • INTERMEDIATES FOR THE PREPARATION OF PYRIDIN-2-YL-AMINO-1,2,4-THIADIAZOLE DERIVATIVES
    申请人:Array BioPharma Inc.
    公开号:US20150057448A1
    公开(公告)日:2015-02-26
    Provided are intermediates having the formulas wherein R 2 , R 3 , and L are as defined in the specification, which are useful in the preparation of pyridin-2-yl-amino-1,2,4-thiadiazole derivatives.
    提供了中间体的公式,其中R2,R3和L的定义如规范中所述,这些中间体在制备吡啶-2-基基-1,2,4-噻二唑生物中很有用。
  • Thrombin Inhibitors
    申请人:CHOBANIAN Harry
    公开号:US20150315141A1
    公开(公告)日:2015-11-05
    Compounds of the invention, which may be useful in inhibiting thrombin and associated thrombotic occlusions, have the following structure: or a pharmaceutically acceptable salt thereof, wherein m is 0 or 1; R is a heterocycle, —(CR 8 R 9 ) 1-2 NH 2 , or —(CR 8 R 9 ) 1-2 OH, wherein R 8 and R 9 , each time in which they occur, are independently H, C 1-6 alkyl, —CH 2 F, —CHF 2 , CF 3 or —CH 2 OH; W is a) —CHR 1 R 2 , where R 1 is —C(CH 3 ) 3 , and R 2 is —(CH 2 ) 1-2 OH, b) a 5- or 6-membered unsubstituted or substituted heterocycle having 1 or 2 heteroatoms selected from N and O, wherein substituted heterocycle is substituted with R 3 , c) a 9- or 10-membered unsubstituted or substituted heterocycle having 1 or 2 heteroatoms selected from N, O and S, wherein substituted heterocycle is mono-substituted with R 3 , or disubstituted with R 3 and R 4 , or d) a 3-, 4-, or 5-membered carbocyclic ring which is unsubstituted, mono-substituted with R 3 , di-substituted with R 3 and R 4 , or tri-substituted with R 3 , R 4 and R 5 ; R 3 is —CF 3 , —COOH, —COOR 7 , —C(O)R 6 , —CH(OH)R 6 , —CH 2 R 6 , R 6 , =O, halogen, R 7 , —OH, —NH 2 , or —NHSO 2 R 7 ; and R 10 is H or C 1-6 alkyl.
    本发明的化合物可用于抑制凝血酶和相关的血栓闭塞,具有以下结构:或其药学上可接受的盐,其中m为0或1;R是杂环,-(CR8R9)1-2NH2,或-(CR8R9)1-2OH,其中每次出现时R8和R9独立且为H、C1-6烷基、-CH2F、-CHF2CF3或- OH;W是a) -CHR1R2,其中R1为-C(CH3)3,R2为-(CH2)1-2OH,b) 1个或2个异原子从N和O中选择的5-或6-成员未取代或取代的杂环,其中取代的杂环取代为R3,c) 1个或2个异原子从N、O和S中选择的9-或10-成员未取代或取代的杂环,其中取代的杂环为单取代的R3,或双取代的R3和R4,或d) 未取代的3-、4-或5-成员碳环,单取代的R3,双取代的R3和R4,或三取代的R3、R4和R5;R3为- 、-COOH、-COOR7、-C(O)R6、-CH(OH)R6、- R6、R6、=O、卤素、R7、-OH、-NH2或-NHSO2R7;R10为H或C1-6烷基。
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