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bis-[(p-methoxybenzyl)cyclopentadienyl]vanadium(IV) diselenocyanate | 1227698-40-9

中文名称
——
中文别名
——
英文名称
bis-[(p-methoxybenzyl)cyclopentadienyl]vanadium(IV) diselenocyanate
英文别名
[η5-C5H4CH2C6H4OCH3]2V(SeCN)2
bis-[(p-methoxybenzyl)cyclopentadienyl]vanadium(IV) diselenocyanate化学式
CAS
1227698-40-9
化学式
C28H26N2O2Se2V
mdl
——
分子量
631.388
InChiKey
XTKIUDSEQXBMDK-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    None
  • 重原子数:
    None
  • 可旋转键数:
    None
  • 环数:
    None
  • sp3杂化的碳原子比例:
    None
  • 拓扑面积:
    None
  • 氢给体数:
    None
  • 氢受体数:
    None

反应信息

  • 作为产物:
    描述:
    bis-[(p-methoxybenzyl)cyclopentadienyl]vanadium(IV) dichloridepotassium selenocyanate四氢呋喃 为溶剂, 以80.9%的产率得到bis-[(p-methoxybenzyl)cyclopentadienyl]vanadium(IV) diselenocyanate
    参考文献:
    名称:
    Antitumor activity of vanadocene Y and its selenocyanate derivative in xenografted caki-1 tumors in mice
    摘要:
    The para-methoxybenzyl-substituted vanadocene dichloride (Vanadocene Y) (1) and its diselenocyanate (Selenocyanato-Vanadocene Y) (2) were tested in vitro in an anti-angiogenesis assay against human umbilical vein endothelial cells (HUVEC) delivering IC50 values of 0.92 +/- 0.03 mu M (1) and 37 +/- 11 mu M (2). In a cytotoxicity assay against the human renal cancer cells, CAKI-1, the compounds demonstrated IC50 values of 0.55 +/- 0.09 mu M (1) and 0.25 +/- 0.03 mu M (2). Then both compounds were given at their maximum tolerable dose, MTD, of 20 mg/kg/d (1) or 40 mg/kg/d (2) on four consecutive days or at 50% of the MTD on five consecutive days per week for three weeks to overall four cohorts of eight CAKI-1 tumor-bearing female NMRI:nu/nu mice each, while a further cohort was treated with solvent only. Both MTD-treated mouse cohorts showed a statistically significant tumor growth reduction with respect to the solvent-treated control group with an optimal T/C value of 47% on day 39 of the experiment. Immunohistological analysis revealed that the expression of the proliferation marker Ki-67 was reduced due to long-term treatment with 2. (C) 2010 Elsevier B.V. All rights reserved.
    DOI:
    10.1016/j.jorganchem.2010.01.026
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