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Citation: Song Xiang-Zhi, Liu Guang, Zhang Shi-Wei. Synthesis and Crystal Structures of Cancer Cell Inducers of Differentiation PMDH[J]. Acta Physico-Chimica Sinica, ;2002, 18(06): 545-549. doi: 10.3866/PKU.WHXB20020615 shu

Synthesis and Crystal Structures of Cancer Cell Inducers of Differentiation PMDH

1.
State Key Laboratory of Molecular Dynamics and Stable Structure, Institute of Physical Chemistry, Peking University, Beijing　100871

Received Date: 30 October 2001
Available Online: 15 June 2002

The effective inducer of differentiation,3,3’-(pentane-1,5-diyl)bis(5,5- dimethylhydantoin) (PMDH), was synthesized and identified by MS, NMR , IR and element analysis. Its synthetic method and route were optimized. The structure of the compound was determined by single crystal X-ray diffraction and compared with other Hexamethylenbisamide(HMBA) derivatives. The crystal structure of PMDH belongs to triclinic space group P. Crystallographic data are: a=0.874 1(4) nm, b=1.114 6(2) nm, c=1.721 0(3) nm; α= 87.20(3)°, β=89.77(3)°, γ=85.12(3)°，V=1.668 6(6) nm3， Dc=1.291 g•cm－3， Z=4， F(000)=696,μ=0.095 mm－1, R1= 0.065 1(for observed data)， wR2=0.165 7(for unique data), S=1.081. The hyndantoin rings are planar. The molecules are linked by intermolecular hydrogen bonds to form infinite one-dimensional molecular chain almost parallel to the b axis.
- Hexamethylenbisamide(HMBA);3,3’-(Pentane-1,5-diyl)bis (5,5-dimethylhydantoin) (PMDH);Anticancer activity;Cancer cell inducers of differentiation;Crystal structure
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