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Pirodavir

CAT: 0931-T1750-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T1750-07Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
124436-59-5
Target
Antiviral, Virus Protease
Related Pathways
Microbiology/Virology, Immunology/Inflammation
Purity
0.9978
Bioactivity
Pirodavir (R77975) (R 77975), the prototype of broad-spectrum anti-picornavirus compounds, is a potent human rhinovirus (HRV) capsid-binding inhibitor.
Smiles
CCOC(=O)c1ccc(OCCC2CCN(CC2)c2ccc(C)nn2)cc1
Molecular Formula
C21H27N3O3
Molecular Weight
369.46
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Pirodavir

Pirodavir is an antipicornavirus agent.

CAS Number124436-59-5
PubChem CID71345
IUPAC Nameethyl 4-[2-[1-(6-methylpyridazin-3-yl)piperidin-4-yl]ethoxy]benzoate
Molecular FormulaC21H27N3O3
Molecular Weight369.5
XLogP3.7
Topological Polar Surface Area64.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count27
Formal Charge0
Complexity446
SMILES
CCOC(=O)C1=CC=C(C=C1)OCCC2CCN(CC2)C3=NN=C(C=C3)C
InChI
InChI=1S/C21H27N3O3/c1-3-26-21(25)18-5-7-19(8-6-18)27-15-12-17-10-13-24(14-11-17)20-9-4-16(2)22-23-20/h4-9,17H,3,10-15H2,1-2H3
InChIKey
KCHIOGFOPPOUJC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pirodavir
CAS: 124436-59-5
CID: 71345
Formula: C21H27N3O3
MW: 369.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight369.5
XLogP33.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass369.20524173
Monoisotopic Mass369.20524173
Topological Polar Surface Area64.6 Ų
Heavy Atom Count27
Formal Charge0
Complexity446
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

CatalogName
BA1637-5Pirodavir
A13207-25Pirodavir 25mg
A13207-10Pirodavir 10mg
A13207-5Pirodavir 5mg
A13207-500Pirodavir 500mg
A13207-100Pirodavir 100mg
A13207-50Pirodavir 50mg
A13207-1Pirodavir 1mg
A13207-10mM-DPirodavir 10mM * 1mL in DMSO
SC3274-5mgPirodavir (HRV capsid-binding inhibitor)

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