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124832-26-4

124832-26-4 structural image
Product Name: Valaciclovir
Formula: C13H20N6O4
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 170-172
Solubility 174 mg/mL at 25 degrees Celsius
LogP -0.3
Dissociation Constants 1.90, 7.47, and 9.43
Other Experimental Properties White to off-white powder. MW: 360.09; maximum solubility in water at 25 °C: 174 mg/mL; pKa1 1.90; pKa2 7.47; pKa3 9.43 /Valacyclovir hydrochloride/

COMPUTED DESCRIPTORS

Molecular Weight 324.34 g/mol
XLogP3 -0.9
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 8
Exact Mass 324.15460314 g/mol
Monoisotopic Mass 324.15460314 g/mol
Topological Polar Surface Area 147 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 483
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
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

Valacyclovir is a L-valyl ester. It has a role as an antiviral drug. It is functionally related to a guanine.

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