摩熵化学
数据库官网
小程序
打开微信扫一扫
首页 分子通 化学资讯 化学百科 反应查询 关于我们
请输入关键词

2-isopropyl-6-methylbenzo[d]thiazole | 1188091-94-2

中文名称
——
中文别名
——
英文名称
2-isopropyl-6-methylbenzo[d]thiazole
英文别名
6-Methyl-2-propan-2-yl-1,3-benzothiazole
2-isopropyl-6-methylbenzo[d]thiazole化学式
CAS
1188091-94-2
化学式
C11H13NS
mdl
MFCD11217424
分子量
191.297
InChiKey
ZPWUAVXLBCNQMC-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):
    3.9
  • 重原子数:
    13
  • 可旋转键数:
    1
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.363
  • 拓扑面积:
    41.1
  • 氢给体数:
    0
  • 氢受体数:
    2

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:
    6-甲基-苯并噻唑异丁酸 在 dipotassium peroxodisulfate 、 silver nitrate 作用下, 以 二氯甲烷 为溶剂, 反应 8.0h, 以93%的产率得到2-isopropyl-6-methylbenzo[d]thiazole
    参考文献:
    名称:
    Silver catalyzed decarboxylative direct C2-alkylation of benzothiazoles with carboxylic acids
    摘要:
    开发了一种新颖且高效的银催化脱羧直接C2烷基化苯并噻唑与羧酸的反应,用于合成2-烷基苯并噻唑。
    DOI:
    10.1039/c3cc48069k
点击查看最新优质反应信息

文献信息

  • Anti-Viral Compounds
    申请人:DeGoey David A.
    公开号:US20100168138A1
    公开(公告)日:2010-07-01
    Compounds effective in inhibiting replication of Hepatitis C virus (“HCV”) are described. This invention also relates to processes of making such compounds, compositions comprising such compounds, and methods of using such compounds to treat HCV infection.
    描述了一种有效抑制丙型肝炎病毒(“HCV”)复制的化合物。本发明还涉及制备这种化合物的方法、包含这种化合物的组合物,以及使用这种化合物治疗HCV感染的方法。
  • [EN] 1,3,4-OXADIAZOLE SULFONAMIDE DERIVATIVE COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND THE PHARMACEUTICAL COMPOSITION COMPRISING THE SAME<br/>[FR] COMPOSÉS DÉRIVÉS DE 1,3,4-OXADIAZOLE SULFONAMIDE SERVANT D'INHIBITEUR DE L'HISTONE DÉSACÉTYLASE 6, ET COMPOSITION PHARMACEUTIQUE COMPRENANT CEUX-CI
    申请人:CHONG KUN DANG PHARMACEUTICAL CORP
    公开号:WO2017018803A1
    公开(公告)日:2017-02-02
    The present invention relates to novel compounds represented by the formula I having histone deacetylase 6 (HDAC6) inhibitory activity, stereoisomers thereof or pharmaceutically acceptable salts thereof, the use thereof for the preparation of therapeutic medicaments, pharmaceutical compositions containing the same, a method for treating diseases using the composition, and methods for preparing the novel compounds. (I) The novel compounds, stereoisomers thereof or pharmaceutically acceptable salts thereof according to the present invention have histone deacetylase (HDAC) inhibitory activity and are effective for the prevention or treatment of HDAC6-mediated diseases.
    本发明涉及具有组蛋白去乙酰化酶6(HDAC6)抑制活性的新化合物,其立体异构体或药学上可接受的盐,其用于制备治疗药物,含有相同化合物的药物组合物,使用该组合物治疗疾病的方法,以及制备新化合物的方法。根据本发明,这些新化合物、其立体异构体或药学上可接受的盐具有组蛋白去乙酰化酶(HDAC)抑制活性,并且对于预防或治疗HDAC6介导的疾病有效。
  • [EN] CD16A BINDING AGENTS AND USES THEREOF<br/>[FR] AGENTS DE LIAISON À CD16A ET LEURS UTILISATIONS
    申请人:KLEO PHARMACEUTICALS INC
    公开号:WO2019136442A1
    公开(公告)日:2019-07-11
    Among other things, the present disclosure provides compounds, compositions thereof, and methods of using the same. In some embodiments, compounds of the present disclosure bind to Fc receptors, e.g., CD16a. In some embodiments, compounds of the present disclosure are useful for treating various conditions, disorders or diseases including cancer.
    在其他方面,本公开提供了化合物、其组合物以及使用这些化合物的方法。在一些实施例中,本公开的化合物与Fc受体结合,例如CD16a。在一些实施例中,本公开的化合物可用于治疗包括癌症在内的各种疾病、疾病或疾病。
  • MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF
    申请人:Yang Bingwei Vera
    公开号:US20100063051A1
    公开(公告)日:2010-03-11
    Novel non-steroidal compounds are provided which are useful in treating diseases associated with modulation of the glucocorticoid receptor, AP-1, and/or NF-κB activity including inflammatory and immune diseases, obesity and diabetes having the structure of formula (I) an enantiomer, diastereomer, tautomer, solvate (e.g. a hydrate), or a pharmaceutically-acceptable salt, thereof, wherein: M is selected from alkyl, substituted alkyl, cycloalkyl, aryl, heterocyclo, and heteroaryl, provided that if M is alkyl then R 6 and R 7 taken together with the carbon atom to which they are both attached are selected from a group other than cycloalkyl; Q is selected from (i) hydrogen, C 1 -C 4 alkyl, and substituted C 1 -C 4 alkyl; or (ii) Q and R 6 are combined with the carbon atoms to which they are attached to form a 3- to 6-membered cycloalkyl; or (iii) Q and M a M are combined with the carbon atom(s) to which they are attached to form a 3- to 7-membered ring containing 1-2 heteroatoms which are independently selected from the group consisting of O, S, SO 2 , and N which ring may be optionally substituted with 0-2 R 5 groups or carbonyl; Z is selected from cycloalkyl, heterocyclo, aryl, or heteroaryl; and M a , Z a , R 1 , R 2 , R 3 , R 4 , R 6 , R 7 , and R 22 are as defined herein. Also provided are pharmaceutical compositions and methods of treating metabolic and inflammatory- or immune-associated diseases or disorders using said compounds.
    提供了一些新型非类固醇化合物,其在治疗与糖皮质激素受体、AP-1和/或NF-κB活性调节相关的疾病中非常有用,包括炎症和免疫性疾病、肥胖症和糖尿病,具有以下结构公式(I)的对映体、顺反异构体、互变异构体、溶剂化物(例如水合物)或其医药上可接受的盐,其中:M选自烷基、取代烷基、环烷基、芳基、杂环烷基和杂芳基,但如果M是烷基,则R6和R7与它们都连接的碳原子一起选自环烷基之外的一组;Q选自(i)氢、C1-C4烷基和取代的C1-C4烷基;或(ii)Q和R6与它们连接的碳原子结合形成3-到6-成员的环烷基;或(iii)Q和MaM与它们连接的碳原子结合形成1-2个杂原子(独立于O、S、SO2和N组成)的3-到7-成员的环,该环可以选择性地用0-2个R5基团或羰基取代;Z选自环烷基、杂环烷基、芳基或杂芳基;而Ma、Za、R1、R2、R3、R4、R6、R7和R22如本文所定义。还提供了制药组合物和使用所述化合物治疗代谢和炎症或免疫相关疾病或紊乱的方法。
  • COMPOUNDS HAVING TRPV1 ANTAGONISTIC ACTIVITY AND USES THEREOF
    申请人:Kurose Noriyuki
    公开号:US20130123239A1
    公开(公告)日:2013-05-16
    The invention relates to compounds of Formula I and pharmaceutically acceptable derivatives thereof, compositions comprising an effective amount of a compound of Formula I or a pharmaceutically acceptable derivative thereof, and methods for treating or preventing a condition such as pain, UI, an ulcer, IBD and IBS, comprising administering to an animal in need thereof an effective amount of a compound of Formula I or a pharmaceutically acceptable derivative thereof.
    本发明涉及公式I的化合物及其药学上可接受的衍生物,包括含有公式I的化合物或其药学上可接受的衍生物的有效量的组合物,并且涉及治疗或预防疼痛、尿失禁、溃疡、炎症性肠病和肠易激综合征等疾病的方法,其中向需要治疗的动物中给予公式I的化合物或其药学上可接受的衍生物的有效量。
查看更多

同类化合物

(1Z)-1-(3-乙基-5-羟基-2(3H)-苯并噻唑基)-2-丙酮 齐拉西酮砜 阳离子蓝NBLH 阳离子荧光黄4GL 锂2-(4-氨基苯基)-5-甲基-1,3-苯并噻唑-7-磺酸酯 铜酸盐(4-),[2-[2-[[2-[3-[[4-氯-6-[乙基[4-[[2-(硫代氧代)乙基]磺酰]苯基]氨基]-1,3,5-三嗪-2-基]氨基]-2-(羟基-kO)-5-硫代苯基]二氮烯基-kN2]苯基甲基]二氮烯基-kN1]-4-硫代苯酸根(6-)-kO]-,(1:4)氢,(SP-4-3)- 铜羟基氟化物 钾2-(4-氨基苯基)-5-甲基-1,3-苯并噻唑-7-磺酸酯 钠3-(2-{(Z)-[3-(3-磺酸丙基)-1,3-苯并噻唑-2(3H)-亚基]甲基}[1]苯并噻吩并[2,3-d][1,3]噻唑-3-鎓-3-基)-1-丙烷磺酸酯 邻氯苯骈噻唑酮 西贝奈迪 螺[3H-1,3-苯并噻唑-2,1'-环戊烷] 螺[3H-1,3-苯并噻唑-2,1'-环己烷] 葡萄属英A 草酸;N-[1-[4-(2-苯基乙基)哌嗪-1-基]丙-2-基]-2-丙-2-基氧基-1,3-苯并噻唑-6-胺 苯酰胺,N-2-苯并噻唑基-4-(苯基甲氧基)- 苯酚,3-[[2-(三苯代甲基)-2H-四唑-5-基]甲基]- 苯胺,N-(3-苯基-2(3H)-苯并噻唑亚基)- 苯碳杂氧杂脒,N-1,2-苯并异噻唑-3-基- 苯甲基2-甲基哌啶-1,2-二羧酸酯 苯并噻唑正离子,2-[3-(1,3-二氢-1,3,3-三甲基-2H-吲哚-2-亚基)-1-丙烯-1-基]-3-乙基-,碘化(1:1) 苯并噻唑正离子,2-[(2-乙氧基-2-羰基乙基)硫代]-3-甲基-,溴化 苯并噻唑啉 苯并噻唑-d4 苯并噻唑-6-腈 苯并噻唑-5-羧酸 苯并噻唑-5-硼酸频哪醇酯 苯并噻唑-4-醛 苯并噻唑-4-乙酸 苯并噻唑-2-磺酸钠 苯并噻唑-2-磺酸 苯并噻唑-2-磺酰氟 苯并噻唑-2-甲醛 苯并噻唑-2-甲酸 苯并噻唑-2-甲基甲胺 苯并噻唑-2-基磺酰氯 苯并噻唑-2-基叠氮化物 苯并噻唑-2-基-邻甲苯-胺 苯并噻唑-2-基-己基-胺 苯并噻唑-2-基-(4-氯-苯基)-胺 苯并噻唑-2-基-(4-氟-苯基)-胺 苯并噻唑-2-基-(4-乙氧基-苯基)-胺 苯并噻唑-2-基-(2-甲氧基-苯基)-胺 苯并噻唑-2-基-(2,6-二甲基-苯基)-胺 苯并噻唑-2-基(对甲苯基)甲醇 苯并噻唑-2-乙酸甲酯 苯并噻唑-2-乙腈 苯并噻唑-2(3H)-酮N2-[1-(吡啶-4-基)乙亚基]腙 苯并噻唑-2 - 丙基 苯并噻唑,6-(3-乙基-2-三氮烯基)-2-甲基-(8CI)