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UNI418

CAT: 0931-T200240-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T200240-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1802068-51-4
Target
SARS-CoV, PI3K
Related Pathways
Microbiology/Virology, PI3K/Akt/mTOR signaling
Bioactivity
UNI418 is a dual inhibitor targeting PIKfyve and PIP5K1C, exhibiting antiviral activity against SARS-CoV-2 (EC50=1.4 μM) . It inhibits the endocytosis of the virus mediated by ACE2 by suppressing PIP5K1C (IC50=60.1 nM; Kd=61 nM) . Additionally, UNI418 impedes the entry of SARS-CoV-2 into host cells by inhibiting the proteolytic activation regulated by PIKfyve (Kd=0.78 nM) .
Smiles
N=1C=CC(=CC1)C2=NC3=CC=CC=C3C(=N2)NC4=NNC(=C4)C=5C=CC=CC5
Molecular Formula
C22H16N6
Molecular Weight
364.4
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(5-phenyl-1h-pyrazol-3-yl)-2-(4-pyridinyl)-4-quinazolinamine
CAS Number1802068-51-4
PubChem CID71295991
IUPAC NameN-(5-phenyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine
Molecular FormulaC22H16N6
Molecular Weight364.4
XLogP4.3
Topological Polar Surface Area79.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity489
SMILES
C1=CC=C(C=C1)C2=CC(=NN2)NC3=NC(=NC4=CC=CC=C43)C5=CC=NC=C5
InChI
InChI=1S/C22H16N6/c1-2-6-15(7-3-1)19-14-20(28-27-19)25-22-17-8-4-5-9-18(17)24-21(26-22)16-10-12-23-13-11-16/h1-14H,(H2,24,25,26,27,28)
InChIKey
OMNOGBPVYFVKRM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(5-phenyl-1h-pyrazol-3-yl)-2-(4-pyridinyl)-4-quinazolinamine
CAS: 1802068-51-4
CID: 71295991
Formula: C22H16N6
MW: 364.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight364.4
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass364.14364454
Monoisotopic Mass364.14364454
Topological Polar Surface Area79.4 Ų
Heavy Atom Count28
Formal Charge0
Complexity489
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
HY-163943-01UNI418

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