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AChE-IN-30

CAT: 0013-GTR19230597-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19230597-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
AChE-IN-30 is a small molecule acetylcholinesterase inhibitor (IC50 = 4.4 μM) with neuroprotective properties. It demonstrates utility in Alzheimer's disease research by reducing ROS accumulation and preventing H2O2-induced apoptosis in cellular models, supporting investigations into oxidative stress-related neurodegeneration.
CAS Number
2937454-22-1
Field of Research
Neuroscience, Signal Transduction
Purity
99.96% (May vary between batches)
Smiles
O=C1C (=O) C (NC2CCN (CC=3C=CC=CC3) CC2) =C1NC4=CC=C (N) C=C4
Molecular Formula
C22H24N4O2
Molecular Weight
376.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

AChE-IN-30
CAS Number2937454-22-1
PubChem CID168459173
IUPAC Name3-(4-aminoanilino)-4-[(1-benzylpiperidin-4-yl)amino]cyclobut-3-ene-1,2-dione
Molecular FormulaC22H24N4O2
Molecular Weight376.5
XLogP2.9
Topological Polar Surface Area87.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count28
Formal Charge0
Complexity610
SMILES
C1CN(CCC1NC2=C(C(=O)C2=O)NC3=CC=C(C=C3)N)CC4=CC=CC=C4
InChI
InChI=1S/C22H24N4O2/c23-16-6-8-17(9-7-16)24-19-20(22(28)21(19)27)25-18-10-12-26(13-11-18)14-15-4-2-1-3-5-15/h1-9,18,24-25H,10-14,23H2
InChIKey
RMNHWEFBTVCRRS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of AChE-IN-30
CAS: 2937454-22-1
CID: 168459173
Formula: C22H24N4O2
MW: 376.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight376.5
XLogP32.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass376.18992602
Monoisotopic Mass376.18992602
Topological Polar Surface Area87.5 Ų
Heavy Atom Count28
Formal Charge0
Complexity610
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
T79251-01AChE-IN-30
HY-175973AChE/BChE-IN-30
A0526-20CAcetylcholinesterase (ACHE, AChE)
304395-01AChE (ACHE, Acetylcholinesterase)
220543-01AChE (Acetylcholinesterase, AChE, ACHE, ACES) discontinued
122871ACHE (Acetylcholinesterase, AChE)
304391AChE (ACHE, Acetylcholinesterase, YT)
A0526-20ACHE, NT (Acetylcholinesterase, AChE)
122871-BiotinACHE (Acetylcholinesterase, AChE) (Biotin)
MBS6368548-01ACHE (Acetylcholinesterase, AChE) (PE)

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