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Compound Y-1

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Category Influenza Virus
CAS 2379438-80-7
Description Compound Y-1 is a neuraminidase inhibitor with IC50 of 0.21 μM. Compound Y-1 exhibits activity against H1N1 influenza virus.
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Product Information

Synonyms Neuraminidase-IN-1; Y-1
IUPAC Name 3,5-dihydroxy-N-[(E)-(4-hydroxy-3-nitrophenyl)methylideneamino]benzamide
Molecular Weight 317.25
Molecular Formula C14H11N3O6
Canonical SMILES C1=CC(=C(C=C1C=NNC(=O)C2=CC(=CC(=C2)O)O)[N+](=O)[O-])O
InChI InChI=1S/C14H11N3O6/c18-10-4-9(5-11(19)6-10)14(21)16-15-7-8-1-2-13(20)12(3-8)17(22)23/h1-7,18-20H,(H,16,21)/b15-7+
InChIKey MCGROFKAAXXTBN-VIZOYTHASA-N
Purity 99.22%
Solubility In vitro:
10 mM in DMSO
Appearance Light yellow to yellow (Solid)
Storage Powder:
-20°C: 3 years
4°C: 2 years
In solvent:
-80°C: 6 months
-20°C: 1 month
Complexity 456
Exact Mass 317.06478508
In Vitro Neuraminidase-IN-1 has good inhibitory effect on the A/WSN/33H1N1 virus strains, with low toxicity and good druggability.
Target IC50: 0.21 μM (neuraminidase)
XLogP3-AA 2.2

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