4'-(1,4'-dimethyl-2'-propyl-1H-[2,5']dibenzimidazolyl-3'-ylmethyl)biphenyl-2-carboxylic acid methyl ester hydrochloride | 884330-05-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 4'-(1,4'-dimethyl-2'-propyl-1H-[2,5']dibenzimidazolyl-3'-ylmethyl)biphenyl-2-carboxylic acid methyl ester hydrochloride
• 英文别名: methyl 4'-[[2-n-propyl-4-methyl-6-(1-methylbenzimidazol-2-yl)-benzimidazol-1-yl]-methyl]-biphenyl-2-carboxylate hydrochloride；Methyl 2-[4-[[4-methyl-6-(1-methylbenzimidazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoate;hydrochloride
• CAS: 884330-05-6
• 化学式: C₃₄H₃₂N₄O₂*ClH
• 分子量: 565.115
• InChiKey: KHTYUXQUISNTOF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.77
• 重原子数：
  41
• 可旋转键数：
  8
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  61.9
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  4'-(1,4'-dimethyl-2'-propyl-1H-[2,5']dibenzimidazolyl-3'-ylmethyl)biphenyl-2-carboxylic acid methyl ester hydrochloride 在 potassium hydroxide 、 溶剂黄146 作用下， 以 乙腈 、 水 为溶剂， 反应 4.0h， 以77%的产率得到替米沙坦
  参考文献：
  名称：

  An Efficient and Impurity-Free Process for Telmisartan:  An Antihypertensive Drug

  摘要：

  Telmisartan (1), a substituted dibenzimidazole derivative, is an antihypertensive drug, essentially used to control blood pressure. An improved, cost-effective, and impurity-free process for telmisartan (1) suitable for large-scale production is described here by addressing various process development issues. The overall yield obtained from this newly developed process is around 50% (over five steps) compared to the literature reported process (21%, over eight steps).

  DOI：

  10.1021/op060200g
• 作为产物：
  描述：

  替米沙坦甲酯 在 盐酸 作用下， 以 甲醇 为溶剂， 以14.8 g的产率得到4'-(1,4'-dimethyl-2'-propyl-1H-[2,5']dibenzimidazolyl-3'-ylmethyl)biphenyl-2-carboxylic acid methyl ester hydrochloride
  参考文献：
  名称：

  An Efficient and Impurity-Free Process for Telmisartan:  An Antihypertensive Drug

  摘要：

  Telmisartan (1), a substituted dibenzimidazole derivative, is an antihypertensive drug, essentially used to control blood pressure. An improved, cost-effective, and impurity-free process for telmisartan (1) suitable for large-scale production is described here by addressing various process development issues. The overall yield obtained from this newly developed process is around 50% (over five steps) compared to the literature reported process (21%, over eight steps).

  DOI：

  10.1021/op060200g

文献信息

• WO2006/44754
  申请人：——

  公开号：——

  公开（公告）日：——
• An Efficient and Impurity-Free Process for Telmisartan:  An Antihypertensive Drug
  作者：Kikkuru Srirami Reddy、Neti Srinivasan、Chinta Raveendra Reddy、Naveenkumar Kolla、Yerremilli Anjaneyulu、Sundaram Venkatraman、Apurba Bhattacharya、Vijayavitthal T. Mathad

  DOI：10.1021/op060200g

  日期：2007.1.1

  Telmisartan (1), a substituted dibenzimidazole derivative, is an antihypertensive drug, essentially used to control blood pressure. An improved, cost-effective, and impurity-free process for telmisartan (1) suitable for large-scale production is described here by addressing various process development issues. The overall yield obtained from this newly developed process is around 50% (over five steps) compared to the literature reported process (21%, over eight steps).