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Chemical structure of BChE-IN-17

GC71321

BChE-IN-17

Also known as methyl 6-[(3-bromophenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

BChE-IN-17 (compound 6n) is a potent and selective BChE inhibitor with IC50s of 10·5 nM and 32·5 nM for eqBChE and hBChE, respectively

ChemicalCAS2425632-57-9MW535.47FormulaC23H23BrN2O4S2
CAS number
2425632-57-9
Molecular weight
535.47
Formula
C23H23BrN2O4S2
Solubility
DMSO : 2 mg/mL (3·74 mM; ultrasonic and warming and heat to 60°C; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)
InChIKey
WLDAPARXRDCLQP-UHFFFAOYSA-N
Catalogue number
GC71321
Brand
GLPBIO
Computed properties PubChem CID 168476161 · XLogP 5.3 · TPSA 112 Ų · H-bond donors 1
XLogP
5.3
TPSA
112 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
32

SMILES CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C3=C(S2)CN(CC3)CC4=CC(=CC=C4)Br)C(=O)OC

Computed descriptors from PubChem (CID 168476161), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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