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84903-82-2

84903-82-2 structural image
Product Name: Deacetyl-O-demethyldiltiazem
Formula: C19H22N2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 358.5 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 358.13511374 g/mol
Monoisotopic Mass 358.13511374 g/mol
Topological Polar Surface Area 89.3 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 454
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
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

Deacetyl-O-demethyldiltiazem is a benzothiazepine.