CONFORMATIONAL PROPERTIES OF BENZODIOXAN DERIVATIVES WITH ALPHA-ADRENERGIC BLOCKING ACTIVITY

被引:0
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作者
BALSAMO, A
MACCHIA, B
MACCHIA, F
MARTINELLI, A
TOGNETTI, P
VERACINI, CA
机构
[1] UNIV PISA, IST CHIM FARMACEUT, I-56100 PISA, ITALY
[2] UNIV PISA, IST CHIM ORGAN, I-56100 PISA, ITALY
[3] UNIV PISA, IST CHIM FIS, I-56100 PISA, ITALY
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中图分类号
R9 [药学];
学科分类号
1007 ;
摘要
Benzodioxan derivatives active on the .alpha.-adrenergic receptor are considered. The half-chair equilibrium of the dioxane ring was studied by 1H-NMR spectroscopy for piperoxan X and quiloflex XII. The preferred conformation was also obtained by PCILO [perturbative configuration interaction using localized orbitals] calculations for X. The results were evaluated to obtain information on the mechanism of the .alpha.-adrenergic drug-receptor interaction.
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页码:371 / 376
页数:6
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