chloro(bis(2-pyridylmethyl)amine)palladium(II) chloride monohydrate | 439120-09-9

• 英文名称: chloro(bis(2-pyridylmethyl)amine)palladium(II) chloride monohydrate
• 英文别名: [Pd(bpma)Cl]Cl*H₂O；[Pd^IICl(bis(2-pyridylmethyl)amine)]Cl*H₂O；[Pd^IICl(bpma)]Cl*H₂O；[Pd(bis(2-pyridylmethyl)amine))(Cl)]Cl*H2O；[Pd(bis(2-pyridylmethyl)amine)Cl]Cl*H2O；[Pd(bpma)(Cl)]Cl*H2O
• CAS: 439120-09-9
• 化学式: C₁₂H₁₃ClN₃Pd*Cl*H₂O
• 分子量: 394.597
• InChiKey: SUNHLHMGABRZCF-UHFFFAOYSA-L

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

• 作为反应物：
  描述：

  chloro(bis(2-pyridylmethyl)amine)palladium(II) chloride monohydrate 在 AgClO₄ 作用下， 以 高氯酸 为溶剂， 生成 [Pd(bpma)(OH)](1+)
  参考文献：
  名称：

  [Pt（bpma）（H 2 O）] 2+和[Pd（bpma）（H 2 O）] 2+与某些亲核试剂反应的动力学和机理研究。[Pd（bpma）（py）]（ClO 4）2的晶体结构

  摘要：

  配合物[Pd（bpma）（H 2 O）] 2+和[Pt（bpma）（H 2 O）] 2+的取代反应，其中bpma =双（2-吡啶基甲基）胺与TU，DMTU和TMTU两种络合物和Cl - ，溴- ，我-和SCN -的铂配合物，进行了研究在含水0.10M的的NaClO 4使用可变温度在pH 2.5停流分光光度计。[Pd（bpma）（H 2 O）] 2+（6.67）中配位水分子的p K a值比[Pt（bpma）（H 2 O）] 2+的p K a值高。观察到的伪一级速率常数k obs（s -1）服从方程k obs＝k 2 [Nu]（Nu ＝亲核试剂）。二级速率常数表明，Pd（II）络合物的反应性比Pt（II）高10 3倍。） 复杂的。对于TMTU，归因于位阻的亲核试剂反应性和对DMTU的诱导作用被发现为[Pt（bpma）（H 2 O）] 2+的DMTU> TU> TMTU和[Pd]的DMTU≈TU>

  DOI：

  10.1039/b602950g
• 作为产物：
  描述：

  盐酸 、 水 、 二甲基吡啶胺 、 palladium dichloride 在 NaOH 作用下， 以 盐酸 、 甲醇 、 水 为溶剂， 以90%的产率得到chloro(bis(2-pyridylmethyl)amine)palladium(II) chloride monohydrate
  参考文献：
  名称：

  螯合的Pd（II）配合物与硫醇在酸性水溶液中反应的动力学和机理。[Pd（bpma）Cl] Cl·H 2 O（bpma =双（2-吡啶基甲基）胺）的合成和晶体结构

  摘要：

  单官能钯（II）配合物[Pd（N–N–H）H 2 O] 2+之间的配合物形成反应动力学，其中N–N–N为2,2'：6'，2''-吡啶（特皮）， 二亚乙基三胺 （dien）或 双（2-吡啶基甲基）胺 （bpma）， 大号半胱氨酸， DL-青霉胺 和 谷胱甘肽，已经在0.10 M的水溶液中进行了研究 高氯酸 介质使用可变温度和-压力停止流 分光光度法。二阶速率常数k 1 298在2.8×10 2和4.4×10 4 M -1 s -1之间变化。对于[Pd（terpy）H 2 O] 2+复合物，观察到最高的反应活性，而谷胱甘肽 是最强的亲核试剂。 激活这些反应的体积在-5.6±0.3至-10.7±1.0cm 3 mol -1之间变化。的负熵和体积激活在替代过程的过渡状态中，支持债券的强劲贡献。通过[Pd（bpma）Cl] Cl·H 2 O的晶体结构已确定。X射线衍射晶体在190 K时为三斜晶，空间

  DOI：

  10.1039/b106038b

文献信息

• [EN] A PALLADIUM COMPLEX WITH HIGH ANTICANCER ACTIVITY<br/>[FR] COMPLEXE DE PALLADIUM À ACTIVITÉ ANTICANCÉREUSE ÉLEVÉE
  申请人：ULUDAĞ ÜNİVERSİTESİ TTO

  公开号：WO2015171095A1

  公开（公告）日：2015-11-12

  The invention relates to the methods for synthesis, chemical structure and in vivo and in vitro anticancer effects of a palladium complex([Pd(bpma)(barb)]X•H2O) with high anticancer activity.

  本发明涉及一种钯配合物([Pd(bpma)(barb)]X•H2O)，其具有高抗癌活性，涉及其合成方法、化学结构以及体内和体外抗癌效果。
• Cationic Pd(II)/Pt(II) 5,5-diethylbarbiturate complexes with bis(2-pyridylmethyl)amine and terpyridine: Synthesis, structures,DNA/BSA interactions, intracellular distribution, cytotoxic activity and induction of apoptosis
  作者：Ceyda Icsel、Veysel T. Yilmaz、Yunus Kaya、Selvi Durmus、Mehmet Sarimahmut、Orhan Buyukgungor、Engin Ulukaya

  DOI：10.1016/j.jinorgbio.2015.08.026

  日期：2015.11

  Four new cationic Pd(II) and Pt(II) 5,5-diethylbarbiturate (barb) complexes, [M(barb)(bpma)]X center dot H2O [M = pd(II), X = Cl (1); M = Pt-II, X = NO3- (2)] and [M(barb)(terPY)]NO3 center dot 0.5H(2)O [M = Pd-II (3); M = Pt-II (4)], where bpma = bis(2-pyridylmethyl)amine and terpy = terpyridine, were synthesized and characterized by elemental analysis, IR, UV-vis, NMR, ESI-MS and X-ray crystallography. The DNA binding properties of the cationic complexes were investigated by spectroscopic titrations, displacement experiments, viscosity, DNA melting and electrophoresis measurements. The results revealed that the complexes effectively bind to FS-DNA (fish sperm DNA) via intercalative/minor groove binding modes with intrinsic binding constants (Kb) in the range of 0.50 x 10(4) - 1.67 x 10(5) M-1. Absorption, emission and synchronous fluorescence measurements showed strong association of the complexes with protein (BSA) through a static mechanism. The mode of interaction of complexes towards DNA and protein was also supported by molecular docking. Complexes 1 and 3 showed significant nuclear uptake in HT-29 cells. In addition, 1 and 3 showed higher inhibition than cisplatin on the growth of MCF-7 and HT-29 cells and induced apoptosis on these cells much more effectively than the rest of the complexes as evidenced by pyknotic nuclear morphology. The levels of caspase-cleaved cytokeratin 18 (M30 antigen) in HT-29 cells treated with 1 and 3 increased in a dose-dependent manner, suggesting apoptosis. Moreover, qRT-PCR experiments showed that I and 3 caused significant increases in the expression of TNFRSF10B in HT-29 cells, indicating the initiation of apoptosis via cell surface death receptors. (C) 2015 Elsevier Inc. All rights reserved.
• Synthesis, characterization, structures and cytotoxic activity of palladium(II) and platinum(II) complexes containing bis(2-pyridylmethyl)amine and saccharinate
  作者：Emel Guney、Veysel T. Yilmaz、Ferda Ari、Orhan Buyukgungor、Engin Ulukaya

  DOI：10.1016/j.poly.2010.09.037

  日期：2011.1

  New palladium(II) and platinum(II) complexes containing bis(2-pyridylmethyl)amine (bpma) and saccharinate (sac), [Pd(bpma)(sac)](sac)center dot 2H(2)O (1), [Pt(bpma)(sac)](sac)-2H(2)O (2), (Pd(bpma)CII(sac)center dot 2H(2)O (3) and [Pt(bpma)(sac)]Cl center dot 1 center dot 5H(2)O (4), were synthesized and characterized by elemental analysis, IR, NMR and TG-DTA. A single-crystal X-ray analysis of 3 and 4 proved a distorted square-planar geometry around the metal ions with one tridentate bpma ligand and one Cl or sac monoanion. The [Pd(bpma)Cl](+) ions in 3 form dimers by intermolecular N-H center dot center dot center dot Cl and Pd center dot center dot center dot Pd interactions. The cations reside in the centers of a hydrogen-bonded honeycomb network formed by the uncoordinated sac ions and the lattice water molecules, while the cations of 4 are connected by N-H center dot center dot center dot Cl and OW-H center dot center dot center dot O hydrogen bonds into one-dimensional chains. Cyclic planar tetrameric and trimeric water clusters were observed in 3 and 4, respectively. Cytotoxicity of 1-4 was tested against A549. C6 and CHO cells. Although 2 and 4 have no cytotoxicity, the best results were achieved for 1 and 3. In particular, the cyctotoxic activity of 3 is comparable to cisplatin. (C) 2010 Elsevier Ltd. All rights reserved.