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Arbidol

CAT: 1410-M37226-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M37226-04Size:25 mg
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Description
Umifenovir is a potent, orally active broad-spectrum antiviral agent with activity against enveloped and non-enveloped viruses, suppressing virus propagation and modulating the expression of inflammatory cytokines for use as an anti-influenza virus agent . It effectively inhibits the fusion of the virus with host cells and is an efficient inhibitor of SARS-CoV-2 in vitro .
CAS Number
131707-25-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
477.42
Molecular Formula
C22H25BrN2O3S
Notes
Research use only, not for human use.
Receptor
Antiviral | SARS-CoV

Chemical Information

Umifenovir

Umifenovir is an indolyl carboxylic acid.

CAS Number131707-25-0
PubChem CID131411
IUPAC Nameethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-(phenylsulfanylmethyl)indole-3-carboxylate
Molecular FormulaC22H25BrN2O3S
Molecular Weight477.4
XLogP4.4
Topological Polar Surface Area80
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count29
Formal Charge0
Complexity546
SMILES
CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C)CSC3=CC=CC=C3
InChI
InChI=1S/C22H25BrN2O3S/c1-5-28-22(27)20-18(13-29-14-9-7-6-8-10-14)25(4)17-11-16(23)21(26)15(19(17)20)12-24(2)3/h6-11,26H,5,12-13H2,1-4H3
InChIKey
KCFYEAOKVJSACF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Umifenovir
CAS: 131707-25-0
CID: 131411
Formula: C22H25BrN2O3S
MW: 477.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight477.4
XLogP34.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass476.07693
Monoisotopic Mass476.07693
Topological Polar Surface Area80 Ų
Heavy Atom Count29
Formal Charge0
Complexity546
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

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