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174484-41-4

174484-41-4 structural image
Product Name: Tipranavir
Formula: C31H33F3N2O5S
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form White solid from ethyl acetate + heptane
Melting Point 86-89 °C
Solubility Insoluble
LogP 6.9
Optical Rotation Specific optical rotation (in ethanol): +20 deg at 25 °C/D

COMPUTED DESCRIPTORS

Molecular Weight 602.7 g/mol
XLogP3 7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 11
Exact Mass 602.20622782 g/mol
Monoisotopic Mass 602.20622782 g/mol
Topological Polar Surface Area 114 Ų
Heavy Atom Count 42
Formal Charge 0
Complexity 1050
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

Tipranavir is a pyridine-2-sulfonamide substituted at C-5 by a trifluoromethyl group and at the sulfonamide nitrogen by a dihydropyrone-containing m-tolyl substituent. It is an HIV-1 protease inhibitor. It has a role as a HIV protease inhibitor and an antiviral drug.