4-Chlormethyl-2-phenyl-1,3-selenazol | 69625-82-7

• 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-Chlormethyl-2-phenyl-1,3-selenazol
• 英文别名: 4-chloromethyl-2-phenyl-selenazole；4-(Chloromethyl)-2-phenyl-1,3-selenazole
• CAS: 69625-82-7
• 化学式: C₁₀H₈ClNSe
• 分子量: 256.593
• InChiKey: LGGZDDUBOATTQM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.54
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  12.9
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  4-Chlormethyl-2-phenyl-1,3-selenazol 在 manganese(IV) oxide 、 硫酸 作用下， 以 氯仿 为溶剂， 生成 2-苯基-1,3-硒唑-4-甲醛
  参考文献：
  名称：

  Shafiee,A. et al., Journal of Heterocyclic Chemistry, 1979, vol. 16, p. 1563 - 1566

  摘要：

  DOI：
• 作为产物：
  描述：

  苯甲腈 在 sodium hydrogen selenide 作用下， 以 丙酮 为溶剂， 反应 10.0h， 生成 4-Chlormethyl-2-phenyl-1,3-selenazol
  参考文献：
  名称：

  Synthesis and antitumor-evaluation of 1,3-selenazole-containing 1,3,4-thiadiazole derivatives

  摘要：

  A series of novel 1,3-selenazole-containing 1,3,4-thiadiazole derivatives bearing Schiff base moieties were synthesized and evaluated for their in vitro antiproliferative activities against human breast cancer cell MCF-7 and mouse lymphocyte leukemia cell L1210 by CCK-8 assay. The majority of the compounds showed better activity against MCF-7 cell, compared with lead compound PCS. In particular, compound 6c was the most potent compound with IC50 value of 4.02 mu M. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2013.10.062

文献信息

• Shafiee, A.; Kiaeay, G.; Vosooghi, M., Journal of Heterocyclic Chemistry, 1981, vol. 18, p. 789 - 793
  作者：Shafiee, A.、Kiaeay, G.、Vosooghi, M.

  DOI：——

  日期：——
• SHAFIEE A.; MAZLOUMI A.; COHEN V. I., J. HETEROCYCL. CHEM., 1979, 16, NO 8, 1563-1566
  作者：SHAFIEE A.、 MAZLOUMI A.、 COHEN V. I.

  DOI：——

  日期：——
• SHAFIEE, A.;KIAEAY, G.;VOSOOGHI, M., J. HETEROCYCL. CHEM., 1981, 18, N 4, 789-793
  作者：SHAFIEE, A.、KIAEAY, G.、VOSOOGHI, M.

  DOI：——

  日期：——
• Synthesis and antitumor-evaluation of 1,3-selenazole-containing 1,3,4-thiadiazole derivatives
  作者：Hai-Chuan Zhao、Yan-Ping Shi、Yu-Ming Liu、Cai-Wen Li、Li-Na Xuan、Peng Wang、Kai Zhang、Bao-Quan Chen

  DOI：10.1016/j.bmcl.2013.10.062

  日期：2013.12

  A series of novel 1,3-selenazole-containing 1,3,4-thiadiazole derivatives bearing Schiff base moieties were synthesized and evaluated for their in vitro antiproliferative activities against human breast cancer cell MCF-7 and mouse lymphocyte leukemia cell L1210 by CCK-8 assay. The majority of the compounds showed better activity against MCF-7 cell, compared with lead compound PCS. In particular, compound 6c was the most potent compound with IC50 value of 4.02 mu M. (C) 2013 Elsevier Ltd. All rights reserved.
• Shafiee,A. et al., Journal of Heterocyclic Chemistry, 1979, vol. 16, p. 1563 - 1566
  作者：Shafiee,A. et al.

  DOI：——

  日期：——