1-[4-(2,5-dihydro-1H-pyrrol-1-ylcarbonyl)benzyl]-4-(3-aminomethylbenzoyl)-1,3,4,5-tetrahydrobenzo-[e][1,4]-diazepin-2-on Mono(trifluoroacetate) | 407620-82-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异吲哚及其衍生物
• 英文名称: 1-[4-(2,5-dihydro-1H-pyrrol-1-ylcarbonyl)benzyl]-4-(3-aminomethylbenzoyl)-1,3,4,5-tetrahydrobenzo-[e][1,4]-diazepin-2-on Mono(trifluoroacetate)
• 英文别名: 4-[3-(Aminomethyl)benzoyl]-1-[[4-(2,5-dihydropyrrole-1-carbonyl)phenyl]methyl]-3,5-dihydro-1,4-benzodiazepin-2-one;2,2,2-trifluoroacetic acid
• CAS: 407620-82-0
• 化学式: C₂HF₃O₂*C₂₉H₂₈N₄O₃
• 分子量: 594.59
• InChiKey: LSZLEGDKKVWTCR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.98
• 重原子数：
  43
• 可旋转键数：
  5
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  124
• 氢给体数：
  2
• 氢受体数：
  9

文献信息

• Benzodiazepine derivatives
  申请人：AJINOMOTO CO. INC

  公开号：US20030186969A1

  公开（公告）日：2003-10-02

  The present invention provides benzodiazepine derivatives of the following formula, analogs thereof and pharmaceutically acceptable salts thereof. The compounds of the present invention have an excellent effect of inhibiting activated blood-coagulation factor X. These compounds are usable as agents for treating various diseases concerned with the activated blood-coagulation factor X. 1

  本发明提供了以下结构的苯二氮卓类衍生物及其类似物和药学上可接受的盐。本发明的化合物具有优异的抑制活化血凝因子X的效果。这些化合物可用作治疗与活化血凝因子X有关的各种疾病的药剂。
• BENZODIAZEPINE DERIVATIVE
  申请人：Ajinomoto Co., Inc.

  公开号：EP1329450A1

  公开（公告）日：2003-07-23

  The present invention provides benzodiazepine derivatives of the following formula, analogs thereof and pharmaceutically acceptable salts thereof. The compounds of the present invention have an excellent effect of inhibiting activated blood-coagulation factor X. These compounds are usable as agents for treating various diseases concerned with the activated blood-coagulation factor X.

  本发明提供了下式的苯并二氮杂卓衍生物、其类似物及其药学上可接受的盐类。本发明的化合物在抑制活化的凝血因子 X 方面有很好的效果，这些化合物可用作治疗与活化的凝血因子 X 有关的各种疾病的药物。