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152918-27-9

152918-27-9 structural image
Product Name: I-AB-MECA
Formula: C18H20IN7O4
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COMPUTED DESCRIPTORS

Molecular Weight 525.3 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 5
Exact Mass 525.06215 g/mol
Monoisotopic Mass 525.06215 g/mol
Topological Polar Surface Area 160 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 619
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

3-iodo-4-aminobenzyl-5'-N-methylcarboxamidoadenosine is a derivative of adenosine in which the 5'-hydroxymethyl group is replaced by N-ethylcarboxamido and one of the hydrogens of the exocyclic amino function is substituted by a 3-iodo-4-aminobenzyl group. It is a member of adenosines, an organoiodine compound and a monocarboxylic acid amide. It is functionally related to an adenosine.