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Nesbuvir

CAT: 1410-M37937-05Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M37937-05Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Nesbuvir is a selective hepatitis C virus (HCV) nonstructural protein 5B (NS5B) RNA-dependent polymerase inhibitor.Nesbuvir has an IC50 of 9 nM against hepatocellular carcinoma cells containing 1b HCV replicons.
CAS Number
691852-58-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
446.49
Molecular Formula
C22H23FN2O5S
Notes
Research use only, not for human use.
Receptor
HCV Protease

Chemical Information

Nesbuvir

Nesbuvir has been investigated for the treatment of Hepatitis C.

CAS Number691852-58-1
PubChem CID11561383
IUPAC Name5-cyclopropyl-2-(4-fluorophenyl)-6-[2-hydroxyethyl(methylsulfonyl)amino]-N-methyl-1-benzofuran-3-carboxamide
Molecular FormulaC22H23FN2O5S
Molecular Weight446.5
XLogP2.7
Topological Polar Surface Area108
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count31
Formal Charge0
Complexity747
SMILES
CNC(=O)C1=C(OC2=CC(=C(C=C21)C3CC3)N(CCO)S(=O)(=O)C)C4=CC=C(C=C4)F
InChI
InChI=1S/C22H23FN2O5S/c1-24-22(27)20-17-11-16(13-3-4-13)18(25(9-10-26)31(2,28)29)12-19(17)30-21(20)14-5-7-15(23)8-6-14/h5-8,11-13,26H,3-4,9-10H2,1-2H3,(H,24,27)
InChIKey
WTDWVLJJJOTABN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Nesbuvir
CAS: 691852-58-1
CID: 11561383
Formula: C22H23FN2O5S
MW: 446.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight446.5
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass446.13117117
Monoisotopic Mass446.13117117
Topological Polar Surface Area108 Ų
Heavy Atom Count31
Formal Charge0
Complexity747
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

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GTR19178916-01Nesbuvir
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A11510-50Nesbuvir 50mg
A11510-25Nesbuvir 25mg
HY-14775R-01Nesbuvir (Standard)
A11510-500Nesbuvir 500mg
A11510-10Nesbuvir 10mg
A11510-5Nesbuvir 5mg
A11510-1Nesbuvir 1mg
SC3323-25mgNesbuvir (HCV inhibitor)

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