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RIG-1 modulator 1

CAT: 0013-GTR19204949-06Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19204949-06Size:50 mg
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Description
This small molecule RIG-1 modulator is a research tool for investigating antiviral innate immunity. It has demonstrated research utility in in vitro studies targeting influenza, HBV, HCV, and HIV infections. Its application extends to exploring host-directed therapeutic strategies against these viral pathogens.
CAS Number
1428729-63-8
Field of Research
Infectious Disease & Virology, Protein Biochemistry
Purity
99.57% (May vary between batches)
Smiles
O=C (NC1=NC=2C=CC=3SC (=NC3C2S1) C) NCCN (C) C
Molecular Formula
C14H17N5OS2
Molecular Weight
335.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

RIG-1 modulator 1
CAS Number1428729-63-8
PubChem CID71549283
IUPAC Name1-[2-(dimethylamino)ethyl]-3-(7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl)urea
Molecular FormulaC14H17N5OS2
Molecular Weight335.5
XLogP2.6
Topological Polar Surface Area127
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity411
SMILES
CC1=NC2=C(S1)C=CC3=C2SC(=N3)NC(=O)NCCN(C)C
InChI
InChI=1S/C14H17N5OS2/c1-8-16-11-10(21-8)5-4-9-12(11)22-14(17-9)18-13(20)15-6-7-19(2)3/h4-5H,6-7H2,1-3H3,(H2,15,17,18,20)
InChIKey
HORUPPJGOWQYBQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of RIG-1 modulator 1
CAS: 1428729-63-8
CID: 71549283
Formula: C14H17N5OS2
MW: 335.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight335.5
XLogP32.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass335.08745253
Monoisotopic Mass335.08745253
Topological Polar Surface Area127 Ų
Heavy Atom Count22
Formal Charge0
Complexity411
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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