(6-Hydroxy-2-cyclohexylbenzo[b]thien-3-yl)[4-[3-(dimethylcarbamoyl)propyl]phenyl]methanone | 150798-24-6

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (6-Hydroxy-2-cyclohexylbenzo[b]thien-3-yl)[4-[3-(dimethylcarbamoyl)propyl]phenyl]methanone
• 英文别名: 4-[4-(2-cyclohexyl-6-hydroxy-1-benzothiophene-3-carbonyl)phenyl]-N,N-dimethylbutanamide
• CAS: 150798-24-6
• 化学式: C₂₇H₃₁NO₃S
• 分子量: 449.614
• InChiKey: JZUOXUKONSAKMC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.2
• 重原子数：
  32
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  85.8
• 氢给体数：
  1
• 氢受体数：
  4

文献信息

• NOVEL BENZOTHIOPHENE DERIVATIVE
  申请人：TEIKOKU HORMONE MFG. CO., LTD.

  公开号：EP0641791A1

  公开（公告）日：1995-03-08

  A benzothiophene derivative represented by general formula (I) or a salt thereof, which has an excellent antiestrogenic activity and is useful for treating breast cancer, endometrial cancer, endometriosis, mastopathy, and so forth. This compound is characterized in that the 2-position, i.e. substituent R², of the benzothiophene ring is substituted by a halogen atom, a lower alkyl group, or a cycloalkyl or cycloalkenyl group which may be substituted by a lower alkyl, hydroxy, acyloxy or oxo.

  一种由通式(I)代表的苯并噻吩衍生物或其盐，具有优异的抗雌激素活性，可用于治疗乳腺癌、子宫内膜癌、子宫内膜异位症、乳腺病等。该化合物的特征在于苯并噻吩环的 2-位，即取代基 R² 被卤原子、低级烷基或环烷基或环烷烯基所取代，而环烷基或环烷烯基可被低级烷基、羟基、酰氧基或氧代所取代。
• US5472962A
  申请人：——

  公开号：US5472962A

  公开（公告）日：1995-12-05