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Chemical structure of GSK 417651A

GC49620

GSK 417651A

Also known as 3,4-dihydro-1H-isoquinolin-2-yl-[2-(4-methoxyanilino)-1,3-thiazol-4-yl]methanone

GSK 417651A is a potent selectivity blocker of the canonical transient receptor channels (TRPC3/6), has block potency for hTRPC3 and hTRPC6 with IC50 values of 1260 nM and 500 nM, respectively

ChemicalCAS736945-96-3MW365.5FormulaC20H19N3O2S
CAS number
736945-96-3
Molecular weight
365.5
Formula
C20H19N3O2S
Solubility
DMSO: soluble
InChIKey
NTXBDULODNTCKP-UHFFFAOYSA-N
Catalogue number
GC49620
Brand
GLPBIO
Computed properties PubChem CID 1096735 · XLogP 4.1 · TPSA 82.7 Ų · H-bond donors 1
XLogP
4.1
TPSA
82.7 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
26

SMILES COC1=CC=C(C=C1)NC2=NC(=CS2)C(=O)N3CCC4=CC=CC=C4C3

Computed descriptors from PubChem (CID 1096735), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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