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CHIKV-IN-5

CAT: 0013-GTR19241493-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19241493-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
CHIKV-IN-5 (Compound 26) is a potent small molecule inhibitor of Chikungunya virus (CHIKV) replication, exhibiting an EC90 of 0.45 μM. It acts during late-stage viral infection by inhibiting structural protein translation. Demonstrating good microsomal stability, this compound has shown efficacy in mouse models, reducing viral tissue spread and associated footpad swelling.
CAS Number
2568903-91-1
Field of Research
Infectious Disease & Virology
Smiles
N#CC1=CC=C (C=C1) NC2=CC=CC (=C2) C=3N=C (SC3) NC (=O) C4=CC=CN=C4SC
Molecular Formula
C23H17N5OS2
Molecular Weight
443.54
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Chikv-IN-5
CAS Number2568903-91-1
PubChem CID155410170
IUPAC NameN-[4-[3-(4-cyanoanilino)phenyl]-1,3-thiazol-2-yl]-2-methylsulfanylpyridine-3-carboxamide
Molecular FormulaC23H17N5OS2
Molecular Weight443.5
XLogP4.8
Topological Polar Surface Area144
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count31
Formal Charge0
Complexity647
SMILES
CSC1=C(C=CC=N1)C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)NC4=CC=C(C=C4)C#N
InChI
InChI=1S/C23H17N5OS2/c1-30-22-19(6-3-11-25-22)21(29)28-23-27-20(14-31-23)16-4-2-5-18(12-16)26-17-9-7-15(13-24)8-10-17/h2-12,14,26H,1H3,(H,27,28,29)
InChIKey
BPGHLYIECPPFTL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Chikv-IN-5
CAS: 2568903-91-1
CID: 155410170
Formula: C23H17N5OS2
MW: 443.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight443.5
XLogP34.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass443.08745253
Monoisotopic Mass443.08745253
Topological Polar Surface Area144 Ų
Heavy Atom Count31
Formal Charge0
Complexity647
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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Alternative Products

CatalogName
HY-169429CHIKV-IN-5
P523334CHIKV-E2 Protein (C-cleavage, CHIKV)
chi-005CHIKV Capsid
T61675-01CHIKV-IN-3
MBS3617179-01CHIKV-IN-2
chi-003CHIKV E2
HY-163088CHIKV-IN-4
P520870CHIKV-E2 Protein (C-His, CHIKV)
chi-002CHIKV Mutant
HY-133135CHIKV-IN-1

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