5-Bromo-6-fluorobenzo[c][1,2,5]oxadiazole 1-oxide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并恶二唑类
• 英文名称: 5-Bromo-6-fluorobenzo[c][1,2,5]oxadiazole 1-oxide
• 英文别名: 5-bromo-6-fluorobenzo[c][1,2,5]oxadiazol-1-oxide；6-bromo-5-fluoro-3-oxido-2,1,3-benzoxadiazol-3-ium
• 化学式: C₆H₂BrFN₂O₂
• 分子量: 232.996
• InChiKey: KRHYYRQNKFFEPX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  12
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  51.5
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  5-Bromo-6-fluorobenzo[c][1,2,5]oxadiazole 1-oxide 在 亚磷酸三乙酯 作用下， 以 乙醇 为溶剂， 生成 5-bromo-6-fluorobenzo[c][1,2,5]oxadiazole
  参考文献：
  名称：

  [EN] TRICYCLIC GPR65 MODULATORS
  [FR] MODULATEURS TRICYCLIQUES DE LA GPR65

  摘要：

  One aspect of the invention relates to a compound of formula (I), or a pharmaceutically acceptable salt or solvate thereof, (I) wherein: ring B is: a monocyclic aromatic group; or a monocyclic or bicyclic heteroaromatic group, each of which is optionally substituted by halo, CN, OH, alkyl, haloalkyl, cycloalkyl, halocycloalkyl, hydroxycycloalkyl, O-cycloalkyl, alkoxy, haloalkoxy, heterocycloalkyl, O- heterocycloalkyl, aryl, heteroaryl, O-aryl, NHCO-alkenyl, NHCO-aryl, -(CH2)q-O-heteroaryl, CONH-aryl, aryloxy-alkyl, O-aralkyl, and CO2-alkyl, wherein said aryl, heteroaryl, heterocycloalkyl, O-cycloalkyl, NHCO-aryl, -(CH2)q-O-heteroaryl, CONH-aryl, aryloxy-alkyl, O-aralkyl, and O-aryl groups are each optionally further substituted by one or more groups independently selected from halo, alkyl, haloalkyl, alkoxy, NHCO-alkyl, NR13R13', SO2-alkyl, CN, hydroxyalkyl, CONR14R14', alkyl-NR15R15', heterocycloalkyl, alkyl-heterocycloalkyl, alkyl- cycloalkyl, aryl, (CH2)m-NHSO2-alkyl, CO2R16, alkoxy-alkyl, haloalkoxy, O-heterocycloalkyl, heteroaryl, alkoxy-alkoxy, and O-(CH2)p-cycloalkyl, where in the latter group, said cycloalkyl group is optionally further substituted by one or more halo, haloalkyl, alkyl or alkoxy groups; m is an integer from 0 to 3; p and q are each independently 0 to 3; Z is CR12; Y is CR10R10', wherein R10and R10'are each independently selected from H, F, alkyl, and haloalkyl; Raand Rbare each independently selected from H and alkyl; R6is selected from H, alkyl, cycloalkyl and hydroxyalkyl; R12is selected from H, alkyl, haloalkyl, halo, OH and O-alkyl; and R13, R13', R14, R14', R15, R15', and R16are each independently selected from H, alkyl, and alkoxyalkyl. Further aspects of the invention relate to compounds of formula (I) for use as a medicament, particularly in the field of immuno-oncology, immunology, and related applications.

  公开号：

  WO2023067322A1
• 作为产物：
  描述：

  4-溴-5-氟-2-硝基苯甲胺 、 氢氧化钾 、 sodium hypochlorite 在 乙酸乙酯 、 氯化钠 、 Sodium sulfate-III 、 crude material 、 silica gel 、 ethyl acetate n-hexane 作用下， 以 乙醇 、 水 为溶剂， 反应 1.83h， 以to give the title compound as pale yellow solid (3.5 g, 42%)的产率得到5-Bromo-6-fluorobenzo[c][1,2,5]oxadiazole 1-oxide
  参考文献：
  名称：

  4-amino-6-(heterocyclic)picolinates and 6-amino-2-(heterocyclic)pyrimidine-4-carboxylates and their use as herbicides

  摘要：

  小说4-氨基-6-（杂环）哌啶酸及其衍生物和6-氨基-2-（杂环）嘧啶-4-羧酸酯及其衍生物可用于控制不良植被。

  公开号：

  US09006250B2

文献信息

• US20140274702A1
  申请人：——

  公开号：——

  公开（公告）日：——
• 4-AMINO-6-(HETEROCYCLIC)PICOLINATES AND 6-AMINO-2-(HETEROCYCLIC) PYRIMIDINE-4-CARBOXYLATES AND THEIR USE AS HERBICIDES
  申请人：Dow AgroSciences LLC

  公开号：EP2970186B1

  公开（公告）日：2020-06-10
• US9006250B2
  申请人：——

  公开号：US9006250B2

  公开（公告）日：2015-04-14
• [EN] 4-AMINO-6-(HETEROCYCLIC)PICOLINATES AND 6-AMINO-2-(HETEROCYCLIC) PYRIMIDINE-4-CARBOXYLATES AND THEIR USE AS HERBICIDES<br/>[FR] 4-AMINO-6-(GROUPE HÉTÉROCYCLIQUE)PICOLINATES ET 6-AMINO-2-(GROUPE HÉTÉROCYCLIQUE)PYRIMIDINE-4-CARBOXYLATES ET LEUR UTILISATION COMME HERBICIDES
  申请人：DOW AGROSCIENCES LLC

  公开号：WO2014151009A1

  公开（公告）日：2014-09-25

  Novel 4-amino-6-(heterocyclic )picolinic acids and their derivatives and 6-amino-2-(heterocyclic )pyrimidine-4-carboxylates and their derivatives are useful to control undesirable vegetation. The occurrence of undesirable vegetation, e.g., weeds, is a constant problem facing famers in crops, pasture, and other settings. Weeds compete with crops and negatively impact crop yield. The use of chemical herbicides is an important tool in controlling undesirable vegetation.