(Z)-2-(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-1-(adamantan-1-yl)ethan-1-one methanesulfonate | 394652-61-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氢异喹啉
• 英文名称: (Z)-2-(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-1-(adamantan-1-yl)ethan-1-one methanesulfonate
• 英文别名: 1-(1-adamantyl)-2-(6-chloro-3,3-dimethyl-4H-isoquinolin-1-yl)ethanone;methanesulfonic acid
• CAS: 394652-61-0
• 化学式: CH₄O₃S*C₂₃H₂₈ClNO
• 分子量: 466.041
• InChiKey: DHSHVDPCJZLEAV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.14
• 重原子数：
  31
• 可旋转键数：
  3
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  92.2
• 氢给体数：
  1
• 氢受体数：
  5

文献信息

• 3,4 Dihydroisoquinoline derivative compounds and drugs containing these compounds as the active ingredient
  申请人：——

  公开号：US20040077643A1

  公开（公告）日：2004-04-22

  A 3,4-dihydroisoquinoline derivative compound of formula (I) or a non-toxic salt thereof and a pharmaceutical agent comprising it as active ingredient (wherein all symbols have the same meaning as described in the specification). The compound of formula (I) has agonizing activity on CB2 receptor and therefore it is useful for the prophilaxis and/or treatment of various diseases such as asthma, nasal allergy, atopic dermatitis, autoimmune diseases, rheumatoid arthritis, immune dysfunction, postoperative pain, carcinomatous pain, etc. 1

  公式（I）的3,4-二氢异喹啉衍生物化合物或其无毒盐，以及包含其作为活性成分的药物剂。公式（I）的化合物对CB2受体具有激动活性，因此对于预防和/或治疗哮喘、鼻过敏、特应性皮炎、自身免疫疾病、类风湿关节炎、免疫功能障碍、术后疼痛、癌症性疼痛等多种疾病是有用的。
• 3,4-DIHYDROISOQUINOLINE DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT
  申请人：ONO PHARMACEUTICAL CO., LTD.

  公开号：EP1306373A1

  公开（公告）日：2003-05-02

  A 3,4-dihydroisoquinoline derivative compound of formula (I) or a non-toxic salt thereof and a pharmaceutical agent comprising it as active ingredient (wherein all symbols have the same meaning as described in the specification). The compound of formula (I) has agonizing activity on CB2 receptor and therefore it is useful for the prophilaxis and/or treatment of various diseases such as asthma, nasal allergy, atopic dermatitis, autoimmune diseases, rheumatoid arthritis, immune dysfunction, postoperative pain, carcinomatous pain, etc.

  一种式（I）的 3,4-二氢异喹啉衍生物化合物或其无毒盐，以及以其为活性成分的药物制剂（其中所有符号的含义与说明书所述相同）。式（I）化合物对 CB2 受体具有激动活性，因此可用于预防和/或治疗各种疾病，如哮喘、鼻过敏、特应性皮炎、自身免疫性疾病、类风湿性关节炎、免疫功能障碍、术后疼痛、癌性疼痛等。
• US6956033B2
  申请人：——

  公开号：US6956033B2

  公开（公告）日：2005-10-18