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Chemical structure of VA-K-14 hydrochloride

GC65946

VA-K-14 hydrochloride

Also known as N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine;hydrochloride

VA-K-14 hydrochloride is a specific thyroid-stimulating hormone receptor (TSHR) antagonist (IC50= 12·3 μM)

ChemicalCAS1171341-19-7MW341.86FormulaC18H16ClN3S
CAS number
1171341-19-7
Molecular weight
341.86
Formula
C18H16ClN3S
Solubility
DMSO : 50 mg/mL (146·26 mM; Need ultrasonic)
InChIKey
MMEANJJDNROSBC-UHFFFAOYSA-N
Catalogue number
GC65946
Brand
GLPBIO
Computed properties PubChem CID 17479126 · TPSA 69 Ų · H-bond donors 3 · H-bond acceptors 3
TPSA
69 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
23

SMILES CNC1=NC(=CS1)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4.Cl

Computed descriptors from PubChem (CID 17479126), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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