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The structure of glibenclamide in the solid state
被引:23
作者:
Sanz, Dionisia
[1
]
Claramunt, Rosa M.
[1
]
Alkorta, Ibon
[2
]
Sanchez-Sanz, Goar
[2
]
Elguero, Jose
[2
]
机构:
[1] UNED, Fac Ciencias, Dept Quim Organ & Bioorgan, E-28040 Madrid, Spain
[2] CSIC, Inst Quim Med, E-28006 Madrid, Spain
关键词:
SSNMR;
GIAO;
B3LYP;
6-311++G(d;
p);
MAGNETIC-RESONANCE-SPECTROSCOPY;
MOLECULAR-ORBITAL METHODS;
C-13;
NMR-SPECTRA;
CHEMICAL-SHIFTS;
DERIVATIVES;
DRUG;
TRANSFORMATION;
POLYMORPHISM;
TAUTOMERISM;
IMPROVEMENT;
D O I:
10.1002/mrc.2868
中图分类号:
O6 [化学];
学科分类号:
0703 ;
摘要:
The structure of glibenclamide, 5-chloro-N-(2-{4-[(cyclohexylamino)carbonyl] aminosulfonyl}phenyl) ethyl)-2-methoxybenzamide, an important antidiabetic drug, has been studied both in solution and in the solid state by a combination of NMR spectroscopy and theoretical calculations. The possibility that glibenclamide suffers a tautomerization under melting to afford a desmotrope was rejected. Copyright (C) 2012 John Wiley & Sons, Ltd.
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页码:246 / 255
页数:10
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