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SARS-CoV-2-IN-15

CAT: 0013-GTR19187642-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19187642-01Size:25 mg
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Description
SARS-CoV-2-IN-15 is a stabilized niclosamide analog with improved oral bioavailability and plasma half-life. This potent antiviral compound inhibits SARS-CoV-2 with an IC50 of 0.49 μM, making it a candidate for in vitro antiviral assays and in vivo efficacy studies against coronavirus infections.
CAS Number
1580-42-3
Field of Research
Infectious Disease & Virology
Smiles
OC1=CC=C (Cl) C=C1C (=O) NC1=CC=CC (=C1) C (F) (F) F
Molecular Formula
C14H9ClF3NO2
Molecular Weight
315.67
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-chloro-2-hydroxy-N-(3-(trifluoromethyl)phenyl)benzamide

has antimalarial activity

CAS Number1580-42-3
PubChem CID5065884
IUPAC Name5-chloro-2-hydroxy-N-[3-(trifluoromethyl)phenyl]benzamide
Molecular FormulaC14H9ClF3NO2
Molecular Weight315.67
XLogP4.5
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity378
SMILES
C1=CC(=CC(=C1)NC(=O)C2=C(C=CC(=C2)Cl)O)C(F)(F)F
InChI
InChI=1S/C14H9ClF3NO2/c15-9-4-5-12(20)11(7-9)13(21)19-10-3-1-2-8(6-10)14(16,17)18/h1-7,20H,(H,19,21)
InChIKey
OAMVIBKEICGPKK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-chloro-2-hydroxy-N-(3-(trifluoromethyl)phenyl)benzamide
CAS: 1580-42-3
CID: 5065884
Formula: C14H9ClF3NO2
MW: 315.67
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.67
XLogP34.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass315.0273907
Monoisotopic Mass315.0273907
Topological Polar Surface Area49.3 Ų
Heavy Atom Count21
Formal Charge0
Complexity378
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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