flutropium bromide structure

flutropium bromide

[(1R,5R)-8-(2-fluoroethyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2,2-diphenylacetate bromide

Also Known As: flutropium bromide|Flubron|Flutropii bromidum|Bromuro de flutropio|Bromure de flutropium|Flutropii bromidum [Latin]|Flutropium bromide hydrate|Ba-598Br|Ba 598 BR|Flutropium bromide [INN:JAN]|Bromure de flutropium [French]|Bromuro de flutropio [Spanish]|Ba 598|KST-1A7093|AC-3448|Benzilic acid-N-beta-fluoroethylnortropine ester methobromide|(1r,5r)-8-(2-fluoroethyl)-3-[2-hydroxy(diphenyl)acetoxy]-8-methyl-8-azoniabicyclo[3.2.1]octane bromide|(8r)-3-alpha-benziloyloxy-8-(2-fluoroethyl)-8-methyl-8-azoniabicyclo[3.2.1]octane bromide|(8r)-8-(2-Fluoroethyl)-3alpha-hydroxy-1alphaH,5alphaH-tropanium bromide, benzilate|8-(2-fluoroethyl)-3 alpha-hydroxy-1 alpha H,5 alpha H-tropanium bromide benzilate|[(1R,5R)-8-(2-fluoroethyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2,2-diphenyl-acetate bromide|[(1R,5R)-8-(2-fluoroethyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2,2-diphenylacetate bromide|[8-(2-fluoroethyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2,2-diphenylacetate bromide|1-alpha-H,5-alpha-H-Tropanium, 8-(2-fluoroethyl)-3-alpha-hydroxy-, bromide, benzilate, (8R)-

CAS: 63516-07-4
Molecular Formula C24H29BrFNO3
Molecular Weight 477.13147 g/mol
LogP 0.58
Topological Polar Surface Area 46.53 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 6
Exact Mass 477.13147
Heavy Atoms 30
Complexity 794.5

Chemical Identifiers

CAS Number 63516-07-4
SMILES C[N+]1([C@@H]2CC[C@@H]1CC(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)CCF.[Br-]

Product Overview

flutropium bromide (CAS 63516-07-4), with molecular formula C24H29BrFNO3 and molecular weight 477.13147 g/mol. IUPAC: [(1R,5R)-8-(2-fluoroethyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2,2-diphenylacetate bromide.

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