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Chemical structure of BTSA1

GC39355

BTSA1

Also known as 5-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)-4-(1,3-thiazol-2-yldiazenyl)-1H-pyrazol-3-one

BTSA1 is a potent, high affinity and orally active BAX activator with an IC50 of 250 nM and an EC50 of 144 nM· BTSA1 binds with high affinity and specificity to the N-terminal activation site and induces conformational changes to BAX leading to BAX-mediated apoptosis

ChemicalCAS314761-14-3MW430.51FormulaC21H14N6OS2
CAS number
314761-14-3
Molecular weight
430.51
Formula
C21H14N6OS2
Solubility
DMSO： 25 mg/mL (58·07 mM)
InChIKey
CTRCXGFSYFTJIW-UHFFFAOYSA-N
Catalogue number
GC39355
Brand
GLPBIO
Computed properties PubChem CID 3857348 · XLogP 5.5 · TPSA 139 Ų · H-bond donors 1
XLogP
5.5
TPSA
139 Ų
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
30

SMILES C1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=C(N3)C4=CC=CC=C4)N=NC5=NC=CS5

Computed descriptors from PubChem (CID 3857348), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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