4-(4-methylhomopiperazin-1-ylmethyl)-N-[4-methyl-3-(4-(pyridin-3-yl)pyrimidin-2-yl)-aminophenyl]benzamide methanesulfonate | 804554-75-4

• 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-(4-methylhomopiperazin-1-ylmethyl)-N-[4-methyl-3-(4-(pyridin-3-yl)pyrimidin-2-yl)-aminophenyl]benzamide methanesulfonate
• 英文别名: 4-(4-methylhomopiperazin-1-ylmethyl)-N-[4-methyl-3-(4-(pyridin-3-yl)pyrimidin-2-yl) aminophenyl]benzamide methanesulfonate；methanesulfonic acid;4-[(4-methyl-1,4-diazepan-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide
• CAS: 804554-75-4
• 化学式: CH₄O₃S*C₃₀H₃₃N₇O
• 分子量: 603.745
• InChiKey: KAZYSKYGTPBIAP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.48
• 重原子数：
  43
• 可旋转键数：
  7
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  149
• 氢给体数：
  3
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  4-((4-methyl-1,4-diazepan-1-yl)methyl)-N-(4-methyl-3-((4-(pyridin-3-yl)pyrimidin-2-yl)amino)phenyl)benzamide 在 甲烷磺酸 作用下， 以 乙醇 为溶剂， 反应 16.0h， 生成 4-(4-methylhomopiperazin-1-ylmethyl)-N-[4-methyl-3-(4-(pyridin-3-yl)pyrimidin-2-yl)-aminophenyl]benzamide methanesulfonate
  参考文献：
  名称：

  N-phenyl-2-pyrimidine-amine derivatives and process for the preparation thereof

  摘要：

  本发明涉及一种对温血动物的肺癌、胃癌、结肠癌、胰腺癌、肝癌、前列腺癌、乳腺癌、慢性或急性白血病、血液恶性肿瘤、脑膨出、膀胱癌、直肠癌或宫颈癌等表现出优越效果的N-苯基-2-嘧啶胺衍生物及其盐。本发明还涉及一种制备该化合物的方法，以及一种用于治疗上述各种疾病的药物组合物，其中包括作为活性成分的该化合物的有效量，以及药用可接受的惰性载体。

  公开号：

  US20040248918A1

文献信息

• [EN] N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF<br/>[FR] DERIVES DE N-PHENYL-2-PYRIMIDINE-AMINE ET PROCEDE DE PREPARATION DE CEUX-CI
  申请人：IL YANG PHARM CO LTD

  公开号：WO2004099186A1

  公开（公告）日：2004-11-18

  The present invention relates to an N-phenyl-2-pyrimidine-amine derivative showing a superior effect on tumor, lung cancer, gastric cancer, etc. of warm-blooded animals and its salt. The present invention also relates to a process for preparing the compound and a pharmaceutical composition for the prevention and treatment of such diseases as tumor, lung cancer, gastric cancer, etc., which comprises the compound as an active ingredient.

  本发明涉及一种对温血动物的肿瘤、肺癌、胃癌等具有优越效果的N-苯基-2-嘧啶胺衍生物及其盐。本发明还涉及一种制备该化合物的方法和一种药物组合物，用于预防和治疗肿瘤、肺癌、胃癌等疾病，其包括该化合物作为活性成分。
• [EN] N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF<br/>[FR] DERIVES DE N-PHENYL-2-PYRIMIDINE-AMINE ET PROCEDE D'ELABORATION CORRESPONDANT
  申请人：IL YANG PHARM CO LTD

  公开号：WO2004099187A1

  公开（公告）日：2004-11-18

  The present invention relates to an N-Phenyl-2-pyrimidine-aminine derivative showing a superior effect on lung cancer, gastric cancer, colon cancer, pancreatic cancer, hepatoma, prostatic cancer, breast cancer, chronic or accute leukemia, hematologic malignancy, encephalophyma, bladder cancer, rectal cancer or cervical cancer, etc. of warm blooded animals and its salt. The present invention also relates to a process for preparing the compound, and to a pharmaceutical composition for the treatment of the above various disease, which comprises an effective amount of the compound as an active ingredient together with pharmaceutically acceptable inert carriers.

  本发明涉及一种对暖血动物的肺癌、胃癌、结肠癌、胰腺癌、肝癌、前列腺癌、乳腺癌、慢性或急性白血病、血液恶性肿瘤、脑瘤、膀胱癌、直肠癌或宫颈癌等表现出优越效果的N-苯基-2-嘧啶-胺衍生物及其盐。本发明还涉及一种制备该化合物的方法，以及一种用于治疗上述各种疾病的药物组合物，其包括作为活性成分的该化合物的有效量，以及药学上可接受的惰性载体。
• US7595323B2
  申请人：——

  公开号：US7595323B2

  公开（公告）日：2009-09-29
• N-phenyl-2-pyrimidine-amine derivatives and process for the preparation thereof
  申请人：IL YANG PHARM. CO., LTD.

  公开号：US20040248918A1

  公开（公告）日：2004-12-09

  The present invention relates to an N-phenyl-2-pyrimidine-amine derivative showing a superior effect on lung cancer, gastric cancer, colon cancer, pancreatic cancer, hepatoma, prostatic cancer, breast cancer, chronic or acute leukemia, hematologic malignancy, encephalophyma, bladder cancer, rectal cancer, or cervical cancer, etc. of warm-blooded animals and its salt. The present invention also relates to a process for preparing the compound, and to a pharmaceutical composition for the treatment of the above various diseases, which comprises an effective amount of the compound as an active ingredient together with pharmaceutically acceptable inert carriers.

  本发明涉及一种对温血动物的肺癌、胃癌、结肠癌、胰腺癌、肝癌、前列腺癌、乳腺癌、慢性或急性白血病、血液恶性肿瘤、脑膨出、膀胱癌、直肠癌或宫颈癌等表现出优越效果的N-苯基-2-嘧啶胺衍生物及其盐。本发明还涉及一种制备该化合物的方法，以及一种用于治疗上述各种疾病的药物组合物，其中包括作为活性成分的该化合物的有效量，以及药用可接受的惰性载体。