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Tipranavir

CAT: 0931-T4578-03Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T4578-03Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
174484-41-4
Target
SARS-CoV, HIV Protease
Related Pathways
Proteases/Proteasome, Microbiology/Virology
Purity
0.9985
Bioactivity
Tipranavir is a protease inhibitor that inhibits HIV-1 resistant to more than 1 protease inhibitor .Tipranavir effectively inhibits HIV-1 protease enzyme activity and dimerisation and has potent activity against multiple protease inhibitor (PI) HIV-1 isolates (IC50 of 66-410 nM) . Tipranavir inhibits SARS-CoV-2 3CLpro activity.
Smiles
CCC[C@@]1(CCc2ccccc2)CC(O)=C([C@H](CC)c2cccc(NS(=O)(=O)c3ccc(cn3)C(F)(F)F)c2)C(=O)O1
Molecular Formula
C31H33F3N2O5S
Molecular Weight
602.66
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Tipranavir

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.

CAS Number174484-41-4
PubChem CID54682461
IUPAC NameN-[3-[(1R)-1-[(2R)-4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propyl-3H-pyran-5-yl]propyl]phenyl]-5-(trifluoromethyl)pyridine-2-sulfonamide
Molecular FormulaC31H33F3N2O5S
Molecular Weight602.7
XLogP7
Topological Polar Surface Area114
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count11
Heavy Atom Count42
Formal Charge0
Complexity1050
SMILES
CCC[C@]1(CC(=C(C(=O)O1)[C@H](CC)C2=CC(=CC=C2)NS(=O)(=O)C3=NC=C(C=C3)C(F)(F)F)O)CCC4=CC=CC=C4
InChI
InChI=1S/C31H33F3N2O5S/c1-3-16-30(17-15-21-9-6-5-7-10-21)19-26(37)28(29(38)41-30)25(4-2)22-11-8-12-24(18-22)36-42(39,40)27-14-13-23(20-35-27)31(32,33)34/h5-14,18,20,25,36-37H,3-4,15-17,19H2,1-2H3/t25-,30-/m1/s1
InChIKey
SUJUHGSWHZTSEU-FYBSXPHGSA-N
Chemical Structure
2D Structure
2D structure of Tipranavir
CAS: 174484-41-4
CID: 54682461
Formula: C31H33F3N2O5S
MW: 602.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight602.7
XLogP37
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count11
Exact Mass602.20622782
Monoisotopic Mass602.20622782
Topological Polar Surface Area114 Ų
Heavy Atom Count42
Formal Charge0
Complexity1050
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
sc-220260Tipranavir
HY-15148S1-01Tipranavir-d7
A15262-100Tipranavir 100mg
sc-220261Tipranavir-d4
A15262-25Tipranavir 25mg
A15262-10Tipranavir 10mg
HY-15148R-01Tipranavir (Standard)
A15262-5Tipranavir 5mg
A15262-1Tipranavir 1mg
A15262-50Tipranavir 50mg

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