Dynamic and structural features of N-Isopropyl-N- {3-[4(4-Methoxybenzoylamino)Phenoxy]-2-Hydroxypropyl} Ammonium Chloride in [2H6]DMSO were investigated by measuring 13C and 1H spin-lattice relaxation rates and 13C- {1H} and 1H- {1H} n.O.e. Correlation times for main and internal reorientational motions were interpreted in terms of internal rotation around the two planal axes. Selective and double-selective 1H spin-lattice relaxation rates were measured, wherefrom relevant proton-proton intramolecular distances were calculated. It was shown that the β1− blocking agent assumes a preferred conformation where extensive intramolecular H-bonding prevents segmental motion along the quaternary ammonium sidechain.

Gaggelli, E., Marchettini, N., Sega, A., Valensin, G. (1989). 1H and 13C NMR Conformational Analysis of Adrenergic Drugs. Part 2. N-Isopropyl-N-{3-[4(4-Methoxybenzoylamino)Phenoxy]-2-Hydroxypropyl} Ammonium Chloride, a New β1-Blocking Agent. SPECTROSCOPY LETTERS, 22(8), 1045-1063 [10.1080/00387018908053957].

1H and 13C NMR Conformational Analysis of Adrenergic Drugs. Part 2. N-Isopropyl-N-{3-[4(4-Methoxybenzoylamino)Phenoxy]-2-Hydroxypropyl} Ammonium Chloride, a New β1-Blocking Agent

Gaggelli, E.;Marchettini, N.;Sega, A.;Valensin, G.
1989-01-01

Abstract

Dynamic and structural features of N-Isopropyl-N- {3-[4(4-Methoxybenzoylamino)Phenoxy]-2-Hydroxypropyl} Ammonium Chloride in [2H6]DMSO were investigated by measuring 13C and 1H spin-lattice relaxation rates and 13C- {1H} and 1H- {1H} n.O.e. Correlation times for main and internal reorientational motions were interpreted in terms of internal rotation around the two planal axes. Selective and double-selective 1H spin-lattice relaxation rates were measured, wherefrom relevant proton-proton intramolecular distances were calculated. It was shown that the β1− blocking agent assumes a preferred conformation where extensive intramolecular H-bonding prevents segmental motion along the quaternary ammonium sidechain.
Gaggelli, E., Marchettini, N., Sega, A., Valensin, G. (1989). 1H and 13C NMR Conformational Analysis of Adrenergic Drugs. Part 2. N-Isopropyl-N-{3-[4(4-Methoxybenzoylamino)Phenoxy]-2-Hydroxypropyl} Ammonium Chloride, a New β1-Blocking Agent. SPECTROSCOPY LETTERS, 22(8), 1045-1063 [10.1080/00387018908053957].
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/11365/32967
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