1-(3-溴-4-氯苯基)丁-1-酮 | 1280786-91-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 1-(3-溴-4-氯苯基)丁-1-酮
• 英文名称: 1-(3-Bromo-4-chlorophenyl)butan-1-one
• CAS: 1280786-91-5
• 化学式: C₁₀H₁₀BrClO
• 分子量: 261.54
• InChiKey: BLFYNZPJCYTXPV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  13
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

文献信息

• TRIAZINE COMPOUNDS AND PHARMACEUTICAL USE THEREOF
  申请人：Japan Tobacco Inc.

  公开号：US20150266834A1

  公开（公告）日：2015-09-24

  Provided is a compound having an mPGES-1 inhibitory activity and useful for the prophylaxis or treatment of pain, rheumatism, osteoarthritis, fever, Alzheimer's disease, multiple sclerosis, arteriosclerosis, glaucoma, ocular hypertension, ischemic retinal disease, systemic scleroderma and cancer including colorectal cancer. A compound represented by the formula [I] or a pharmaceutically acceptable salt thereof: wherein each symbol is as defined in the SPECIFICATION.

  提供一种具有mPGES-1抑制活性的化合物，可用于预防或治疗疼痛、风湿病、骨关节炎、发热、阿尔茨海默病、多发性硬化症、动脉硬化、青光眼、眼压增高、缺血性视网膜疾病、全身性硬皮病和包括结肠癌在内的癌症。该化合物由式[I]表示，或其药用可接受的盐：其中每个符号如规范中定义。
• PROCESS FOR THE PREPARATION OF TRIAZINE DERIVATIVES
  申请人：Japan Tobacco Inc.

  公开号：EP3456713A1

  公开（公告）日：2019-03-20

  Provided is a process for the production of a compound represented by the formula [I] or a pharmaceutically acceptable salt thereof: wherein each symbol is as defined in the specification. Said compound has an mPGES-1 inhibitory activity and is useful for the prophylaxis or treatment of pain, rheumatism, osteoarthritis, fever, Alzheimer's disease, multiple sclerosis, arteriosclerosis, glaucoma, ocular hypertension, ischemic retinal disease, systemic scleroderma and cancer including colorectal cancer.

  本发明提供了一种生产式 [I] 所代表的化合物或其药学上可接受的盐的工艺： 其中各符号如说明书中所定义。所述化合物具有 mPGES-1 抑制活性，可用于预防或治疗疼痛、风湿病、骨关节炎、发热、老年痴呆症、多发性硬化症、动脉硬化、青光眼、眼压过高、缺血性视网膜疾病、系统性硬皮病和癌症（包括结直肠癌）。
• TRIAZINE COMPOUND AND USE THEREOF FOR MEDICAL PURPOSES
  申请人：Japan Tobacco, Inc.

  公开号：EP3109240B1

  公开（公告）日：2018-10-24