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Chemical structure of STAT6-IN-5

GC75679

STAT6-IN-5

Also known as 2-[4-(1,3-dimethyl-5-oxo-1,2,4-triazol-4-yl)phenyl]-1-(2-methoxyethyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(trifluoromethyl)indole-7-carboxamide

STAT6-IN-5 (84) is a STAT6 inhibitor, with an IC50 of 0·24 μM

ChemicalCAS3033742-22-9MW571.57FormulaC26H24F3N7O3S
CAS number
3033742-22-9
Molecular weight
571.57
Formula
C26H24F3N7O3S
Solubility
DMSO： 100 mg/mL (174·96 mM; Need ultrasonic)
InChIKey
VFABOOWBMOMFOL-UHFFFAOYSA-N
Catalogue number
GC75679
Brand
GLPBIO
Computed properties PubChem CID 171714310 · XLogP 3.5 · TPSA 133 Ų · H-bond donors 1
XLogP
3.5
TPSA
133 Ų
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
7
Heavy atoms
40

SMILES CC1=NN(C(=O)N1C2=CC=C(C=C2)C3=CC4=CC(=CC(=C4N3CCOC)C(=O)NC5=NN=C(S5)C)C(F)(F)F)C

Computed descriptors from PubChem (CID 171714310), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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