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118457-15-1

118457-15-1 structural image
Product Name: (+)-Nebivolol
Formula: C22H25F2NO4
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COMPUTED DESCRIPTORS

Molecular Weight 405.4 g/mol
XLogP3 3
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 405.17516460 g/mol
Monoisotopic Mass 405.17516460 g/mol
Topological Polar Surface Area 71 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 483
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

(S,R,R,R)-nebivolol is a 2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol] that has (1R,1'R,2R,2'S)-configuration. It is a conjugate base of a (S,R,R,R)-nebivolol(1+). It is an enantiomer of a (R,S,S,S)-nebivolol.