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T6167923

CAT: 1410-M10343Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1410-M10343Size:1 Each
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Description
T6167923 (T-6167923) is a small molecule inhibitor of MyD88-dependent signaling pathways, disrupts MyD88 homodimeric formation; inhibits SEB-induced inhibition of cytokine production in PBMCs with IC50 of 2-10 uM, also inhibits SEA-induced pro-inflammatory cytokine production.
CAS Number
1090528-71-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
458.389
Molecular Formula
C17H20BrN3O3S2
Notes
Research use only, not for human use.
Receptor
MyD88

Chemical Information

4-(3-bromobenzenesulfonyl)-N-[1-(thiophen-2-yl)ethyl]piperazine-1-carboxamide
CAS Number1090528-71-4
PubChem CID42890397
IUPAC Name4-(3-bromophenyl)sulfonyl-N-(1-thiophen-2-ylethyl)piperazine-1-carboxamide
Molecular FormulaC17H20BrN3O3S2
Molecular Weight458.4
XLogP2.5
Topological Polar Surface Area106
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity591
SMILES
CC(C1=CC=CS1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br
InChI
InChI=1S/C17H20BrN3O3S2/c1-13(16-6-3-11-25-16)19-17(22)20-7-9-21(10-8-20)26(23,24)15-5-2-4-14(18)12-15/h2-6,11-13H,7-10H2,1H3,(H,19,22)
InChIKey
PNTQVMBKHCOLQD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(3-bromobenzenesulfonyl)-N-[1-(thiophen-2-yl)ethyl]piperazine-1-carboxamide
CAS: 1090528-71-4
CID: 42890397
Formula: C17H20BrN3O3S2
MW: 458.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight458.4
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass457.01295
Monoisotopic Mass457.01295
Topological Polar Surface Area106 Ų
Heavy Atom Count26
Formal Charge0
Complexity591
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5753995T6167923
GTR19244370-01T6167923 B

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