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Synthesis,Crystal Structure and PTPs Inhibition of a Zinc(Ⅱ) Complex with N-(4-hydroxybenzyl)-L-serine

Synthesis, Crystal Structure and PTPs Inhibition of a Zinc(Ⅱ) Complex with N-(4-hydroxybenzyl)-L-serine
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摘要 The reaction of the reduced Schiff base HL(N-(4-hydroxybenzyl)-L-serine) with Zn(CH3COO)2·2H2O in aqueous solution afforded [Zn(L)2]·3H2O(I). The complex has been characterized by elemental analysis, FT-IR, powder X-ray diffraction, electrospray ionization mass spectrometry and single-crystal X-ray diffraction. Complex I crystallizes in the orthorhombic system, space group P212121, with a=9.197(2), b=10.445(2), c=24.149(5) , V=2319.8(8) 3, Z=4, C(20)H(30)N2O11 Zn, Mr=539.83, Dc=1.546 g·cm3, μ=1.122 mm(-1), F(000)=1128, GOOF=0.971, the final R=0.0206 and w R=0.0506 for 4346 observed reflections(I > 2σ(I)). In complex I, each Zn(II) ion coordinates with three carboxyl oxygen atoms and two amine nitrogen atoms from three L-anions, forming a distorted five-coordinated trigonal bipyramidal geometry. Complex I exhibits a 1D wavy chain structure that is extended by hydrogen-bonding interactions to form a supramolecular network. The bioactivity of the complex as a potential PTPs inhibitor in vitro was investigated, displaying potent inhibition against PTP1B(IC(50), 0.24 μM) and TCPTP(IC(50), 0.53 μM) with a moderate selectivity. The reaction of the reduced Schiff base HL(N-(4-hydroxybenzyl)-L-serine) with Zn(CH3COO)2·2H2O in aqueous solution afforded [Zn(L)2]·3H2O(I). The complex has been characterized by elemental analysis, FT-IR, powder X-ray diffraction, electrospray ionization mass spectrometry and single-crystal X-ray diffraction. Complex I crystallizes in the orthorhombic system, space group P212121, with a=9.197(2), b=10.445(2), c=24.149(5) , V=2319.8(8) 3, Z=4, C(20)H(30)N2O11 Zn, Mr=539.83, Dc=1.546 g·cm3, μ=1.122 mm(-1), F(000)=1128, GOOF=0.971, the final R=0.0206 and w R=0.0506 for 4346 observed reflections(I > 2σ(I)). In complex I, each Zn(II) ion coordinates with three carboxyl oxygen atoms and two amine nitrogen atoms from three L-anions, forming a distorted five-coordinated trigonal bipyramidal geometry. Complex I exhibits a 1D wavy chain structure that is extended by hydrogen-bonding interactions to form a supramolecular network. The bioactivity of the complex as a potential PTPs inhibitor in vitro was investigated, displaying potent inhibition against PTP1B(IC(50), 0.24 μM) and TCPTP(IC(50), 0.53 μM) with a moderate selectivity.
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2017年第2期316-323,共8页 结构化学(英文)
基金 Supported by NNSFC(Nos.21271121,21471092,21571118)
关键词 hydroxybenzyl Zinc Complex with N Synthesis carboxyl coordinated supramolecular distorted selectivity serine hydroxybenzyl Zinc Complex with N Synthesis carboxyl coordinated supramolecular distorted selectivity serine
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