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40580-59-4

40580-59-4 structural image
Product Name: Guanadrel
Formula: C10H19N3O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 213.5-215
Solubility 1.93e+00 g/L
LogP 0.6

COMPUTED DESCRIPTORS

Molecular Weight 213.28 g/mol
XLogP3 0
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 213.147726857 g/mol
Monoisotopic Mass 213.147726857 g/mol
Topological Polar Surface Area 82.9 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 245
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Guanadrel is a spiroketal resulting from the formal condensation of the keto group of cyclohexanone with the hydroxy groups of 1-(2,3-dihydroxypropyl)guanidine. A postganglionic adrenergic blocking agent formerly used (generally as the sulfate salt) for the management of hypertension, it has been largely superseded by other drugs less likely to cause orthostatic hypotension (dizzy spells on standing up or stretching). It has a role as an antihypertensive agent and an adrenergic antagonist. It is a member of guanidines and a spiroketal. It is a conjugate base of a guanadrel(1+).