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152529-79-8

152529-79-8 structural image
Product Name: 4-(2,3,6,7-TETRAHYDRO-2,6-DIOXO-1-PROPYL-1H-PURIN-8-YL)-BENZENESULFONIC ACID
Formula: C14H14N4O5S
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COMPUTED DESCRIPTORS

Molecular Weight 350.35 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 350.06849073 g/mol
Monoisotopic Mass 350.06849073 g/mol
Topological Polar Surface Area 141 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 611
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
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

4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)benzenesulfonic acid is an oxopurine.