2-chloro-4,6-bis(2-phenylhydrazinyl)-1,3,5-triazine | 78912-11-5

• 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: 2-chloro-4,6-bis(2-phenylhydrazinyl)-1,3,5-triazine
• 英文别名: 2,4-diphenylhydrazino-6-chlorotriazine；chloro-bis-(N'-phenyl-hydrazino)-[1,3,5]triazine；Chlor-bis-(N'-phenyl-hydrazino)-[1,3,5]triazin；1-[4-chloro-6-(2-phenylhydrazinyl)-1,3,5-triazin-2-yl]-2-phenylhydrazine
• CAS: 78912-11-5
• 化学式: C₁₅H₁₄ClN₇
• 分子量: 327.776
• InChiKey: IOQSSGPIPXQJBN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  23.0
• 可旋转键数：
  6.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  86.79
• 氢给体数：
  4.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  5-苄氨基-[1,3,4]噻二唑-2-硫醇 、 2-chloro-4,6-bis(2-phenylhydrazinyl)-1,3,5-triazine 生成 N-benzyl-5-[[4,6-bis(2-phenylhydrazinyl)-1,3,5-triazin-2-yl]sulfanyl]-1,3,4-thiadiazol-2-amine
  参考文献：
  名称：

  COWPER, A. J.;TRIVEDI, G. S.;ASTIK, R. R.;THAKER, K. A., J. INST. CHEM., 1981, 53, N 2, 85-88

  摘要：

  DOI：
• 作为产物：
  描述：

  三聚氯氰 、 苯肼 在 乙醚 作用下， 生成 2-chloro-4,6-bis(2-phenylhydrazinyl)-1,3,5-triazine
  参考文献：
  名称：

  Fries, Chemische Berichte, 1886, vol. 19, p. 2056

  摘要：

  DOI：

文献信息

• Novel 1,3,5-triazine derivatives exert potent anti-cervical cancer effects by modulating Bax, Bcl2 and Caspases expression
  作者：Xiwen Wang、Yuexiong Yi、Qiongying Lv、Juan Zhang、Kejia Wu、Wanrong Wu、Wei Zhang

  DOI：10.1111/cbdd.13133

  日期：2018.3

  This study aimed to develop novel 1,3,5‐triazine derivatives as potent anti‐cervical cancer agents. The compounds were synthesized in short steps with an excellent yield and characterized via various spectroscopic and analytical methods. A structure–activity relationship study suggested that electron‐withdrawing substituents showed greater anticancer activity than electron‐donating groups. Compound 7p (p‐fluoro) showed the highest activity against cervical cancer cells. In a nude mouse xenograft model inoculated with HeLa cells, 7p showed dose‐dependent inhibition of cervical tumour growth. Histopathological examination of excised tumour‐bearing tissues showed that 7p improved the microstructure in a dose‐dependent manner. Compound 7p also increased the proportions of HeLa cells in G0/G1 and S‐phase and significantly decreased that of G2/M‐phase. The effects of 7p on C‐caspase‐3, C‐caspase‐9, Bcl‐2 and Bax expression in HeLa cells were also determined.
• PANDYA, U. H.;ASTIK, R. R.;THAKER, K. A., J. INST. CHEM., 1981, 53, N 2, 69-70
  作者：PANDYA, U. H.、ASTIK, R. R.、THAKER, K. A.

  DOI：——

  日期：——
• TRIVEDI, G. S.;COWPER, A. J.;ASTIK, R. R.;THAKER, K. A., J. INST. CHEM. (INDIA), 1981, 53, N 3, 135-138
  作者：TRIVEDI, G. S.、COWPER, A. J.、ASTIK, R. R.、THAKER, K. A.

  DOI：——

  日期：——
• COWPER, A. J.;TRIVEDI, G. S.;ASTIK, R. R.;THAKER, K. A., J. INST. CHEM. (INDIA), 1981, 53, N 3, 141-144
  作者：COWPER, A. J.、TRIVEDI, G. S.、ASTIK, R. R.、THAKER, K. A.

  DOI：——

  日期：——