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(4-((4-nitrophenyl)amino)-4-oxobutyl)triphenylphosphonium chloride | 1030608-31-1

中文名称
——
中文别名
——
英文名称
(4-((4-nitrophenyl)amino)-4-oxobutyl)triphenylphosphonium chloride
英文别名
——
(4-((4-nitrophenyl)amino)-4-oxobutyl)triphenylphosphonium chloride化学式
CAS
1030608-31-1
化学式
C28H26N2O3P*Cl
mdl
——
分子量
504.953
InChiKey
CLOGQEICMBOJPD-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):
    2.31
  • 重原子数:
    35.0
  • 可旋转键数:
    9.0
  • 环数:
    4.0
  • sp3杂化的碳原子比例:
    0.11
  • 拓扑面积:
    72.24
  • 氢给体数:
    1.0
  • 氢受体数:
    3.0

反应信息

  • 作为产物:
    描述:
    三苯基膦N-(4'-nitrophenyl)-4-chlorobutanamide 以39.8%的产率得到(4-((4-nitrophenyl)amino)-4-oxobutyl)triphenylphosphonium chloride
    参考文献:
    名称:
    Anticancer activities of some arylcarbamoylalkyltriphenylphosphonium chlorides
    摘要:
    A series of novel arylcarbamoylalkyltriphenylphosphonium chlorides were synthesized. The newly synthesized compounds, [R-(p-C6H4)-NH-CO-R1P circle plus (C6H4)(3)] C1(theta), R = H (2), CH3 (4), NO2 (6), R-1 = -CH2-(b), CH3CH<(a), -CH2CH2- (c), -CH2CH2CH2 (d), the analogs of an anticancer drug, were characterized by infrared (IR), H-1 nuclear magnetic resonance (NMR), C-13-NMR, (PNMR)-P-31, mass spectrometry ( MS), thermogravimetry ( TG), and conductivity measurements. The anticancer activities of the obtained compounds were measured by MTT. The preliminary results indicated that some compounds showed potent anticancer activities against HCT-8, Bel-7402, A549, and S180.
    DOI:
    10.1007/s00044-007-9050-7
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