N-(2,4-dichlorophenyl)-N'-phenylthiourea | 13528-25-1

• 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: N-(2,4-dichlorophenyl)-N'-phenylthiourea
• 英文别名: N-(2,4-dichloro-phenyl)-N'-phenyl-thiourea；N-(2,4-Dichlor-phenyl)-N'-phenyl-thioharnstoff；1-(2,4-dichlorophenyl)-3-phenylthiourea
• CAS: 13528-25-1
• 化学式: C₁₃H₁₀Cl₂N₂S
• 分子量: 297.208
• InChiKey: YTBLBUCXWXBYTR-UHFFFAOYSA-N

物化性质

• 熔点：
  157 °C
• 沸点：
  395.9±52.0 °C(Predicted)
• 密度：
  1.474±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  18
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  56.2
• 氢给体数：
  2
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  N-(2,4-dichlorophenyl)-N'-phenylthiourea 在 sodium acetate 、 乙酰氯 作用下， 以 溶剂黄146 为溶剂， 反应 12.0h， 生成 3-(2,4-dichlorophenyl)-5-(3-fluorobenzylidene)-1-phenylthiobarbituric acid
  参考文献：
  名称：

  Kumar, P.; Nath, C.; Agarwal, Jagdish C., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1983, vol. 22, # 9, p. 955 - 958

  摘要：

  DOI：
• 作为产物：
  描述：

  N-(2,4-dibromo-phenyl)-N'-phenyl-thiourea 在 硫酸 作用下， 生成 N-(2,4-dichlorophenyl)-N'-phenylthiourea
  参考文献：
  名称：

  Chattaway; Hardy; Watts, Journal of the Chemical Society, 1924, vol. 125, p. 1555

  摘要：

  DOI：

文献信息

• DESULFURIZATION OF THIOUREAS BY BROMATE AND IODATE SOLUTIONS
  作者：Hubert H. Capps、William M. Dehn

  DOI：10.1021/ja01350a023

  日期：1932.11
• KUMAR, P.;NATH, C.;JAGDISH, AGARWAL, C.;BHARGAVA, K. P.;SHANKER, K., INDIAN J. CHEM., 1983, 22, N 9, 955-958
  作者：KUMAR, P.、NATH, C.、JAGDISH, AGARWAL, C.、BHARGAVA, K. P.、SHANKER, K.

  DOI：——

  日期：——
• UREA DERIVATIVES FOR TREATING AND/OR PREVENTING CANCER
  申请人：CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE

  公开号：US20210380547A1

  公开（公告）日：2021-12-09

  The present invention relates to a compound or a pharmaceutically acceptable salt thereof of formulae (I) and (II), and a pharmaceutical composition comprising such compound for use for treating a cancer, particularly a cancer overexpressing CXCR1 and CXCR2 receptors, such as medulloblastoma, head and neck and kidney cancer. The invention further relates to such compounds for use for treating macular degeneration.
• [EN] UREA DERIVATIVES FOR TREATING AND/OR PREVENTING CANCER<br/>[FR] DÉRIVÉS D'URÉE POUR LE TRAITEMENT ET/OU LA PRÉVENTION DU CANCER
  申请人：CENTRE NAT RECH SCIENT

  公开号：WO2020079184A2

  公开（公告）日：2020-04-23

  The present invention relates to a compound or a pharmaceutically acceptable salt thereof of formulae (I) and (II), and a pharmaceutical composition comprising such compound for use for treating a cancer, particularly a cancer overexpressing CXCR1 and CXCR2 receptors, such as medulloblastoma, head and neck and kidney cancer. The invention further relates to such compounds for use for treating macular degeneration.
• Kumar, P.; Nath, C.; Agarwal, Jagdish C., Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1983, vol. 22, # 9, p. 955 - 958
  作者：Kumar, P.、Nath, C.、Agarwal, Jagdish C.、Bhargava, K. P.、Shanker, K.

  DOI：——

  日期：——