N-[5-(4-methoxybenzyl)-[1,3,4]thiadiazol-2-yl]-3-phenylpropionamide | 521294-90-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: N-[5-(4-methoxybenzyl)-[1,3,4]thiadiazol-2-yl]-3-phenylpropionamide
• 英文别名: N-(5-(4-methoxybenzyl)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide；N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
• CAS: 521294-90-6
• 化学式: C₁₉H₁₉N₃O₂S
• mdl: MFCD03351958
• 分子量: 353.445
• InChiKey: ZZFOPXIKUTVHJB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  25
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  92.4
• 氢给体数：
  1
• 氢受体数：
  5

文献信息

• NOVEL TUBULIN INHIBITORS AND METHODS OF USING THE SAME
  申请人：Chen Meng-Hsin

  公开号：US20120172374A1

  公开（公告）日：2012-07-05

  Compounds represented by the formula (I) or pharmaceutically acceptable salts thereof: R 2 —Y—Z-Q-A-R 1 Formula (I) wherein R 1 , R 2 , Y, Z, Q, and A are as defined. These compounds are inhibitors of tubulin polymerization by binding at colchicines binding site and are useful in the treatment of tumors or mitotic diseases such as cancers, gout, and other conditions associated with abnormal cell proliferation.

  由以下公式（I）代表的化合物或其药用盐：R2—Y—Z-Q-A-R1 公式（I） 其中R1、R2、Y、Z、Q和A如定义。这些化合物通过结合秋水仙碱结合位点来抑制微管聚合，可用于治疗肿瘤或有丝分裂疾病，如癌症、痛风和其他与异常细胞增殖有关的疾病。
• US8883793B2
  申请人：——

  公开号：US8883793B2

  公开（公告）日：2014-11-11
• [EN] NOVEL TUBULIN INHIBITORS AND METHODS OF USING THE SAME<br/>[FR] NOUVEAUX INHIBITEURS DE TUBULINE ET PROCÉDÉS POUR LES UTILISER
  申请人：DEV CENTER BIOTECHNOLOGY

  公开号：WO2012092471A2

  公开（公告）日：2012-07-05

  Compounds represented by the formula (I) or pharmaceutically acceptable salts thereof: R2-Y-Z-Q-A-R1 Formula (I) wherein R1, R2, Y, Z, Q, and A are as defined. These compounds are inhibitors of tubulin polymerization by binding at colchicines binding site and are useful in the treatment of tumors or mitotic diseases such as cancers, gout, and other conditions associated with abnormal cell proliferation.