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Icopezil

CAT: 0013-GTR19213679-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19213679-02Size:5 mg
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Description
Icopezil is a small molecule acetylcholinesterase (AChE) inhibitor used in neuroscience research. It serves as a tool compound for investigating cholinergic function in models of Alzheimer's disease and other neurological disorders, applicable in both in vitro enzymatic assays and in vivo behavioral studies.
CAS Number
145508-78-7
Product Name Alternative
AChE
Field of Research
Neuroscience
Purity
98.16% (May vary between batches)
Solubility
DMSO:50 mg/mL (133.17 mM)
Smiles
C (CC1CCN (CC2=CC=CC=C2) CC1) C=3C4=C (C=C5C (=C4) CC (=O) N5) ON3
Molecular Formula
C23H25N3O2
Molecular Weight
375.46
References & Citations
Ye Bin Shin 1, Jin Hwan Kim 1, Min Kyeong Kwon 1, Jin Hyuk Myung 1, Dong Geon Lee 1, Sung Giu Jin 2, Myung Joo Kang 1, Yong Seok Choi Optimized method development and validation for determining donepezil in rat plasma: A liquid-liquid extraction, LC-MS/MS, and design of experiments approach PLoS One, (2024), Min Young Jeong et al. Coupling syringe system comprising drug nanosuspension and photo-crosslinked gelatin methacryloyl hydrogel for subcutaneous delivery with decreased initial exposure Materials & Design, (2025)
Pubmed id
39240870
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Icopezil

Icopezil is a small molecule drug. Icopezil has a monoisotopic molecular weight of 375.19 Da.

CAS Number145508-78-7
PubChem CID172972
IUPAC Name3-[2-(1-benzylpiperidin-4-yl)ethyl]-5,7-dihydropyrrolo[3,2-f][1,2]benzoxazol-6-one
Molecular FormulaC23H25N3O2
Molecular Weight375.5
XLogP3.5
Topological Polar Surface Area58.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity542
SMILES
C1CN(CCC1CCC2=NOC3=C2C=C4CC(=O)NC4=C3)CC5=CC=CC=C5
InChI
InChI=1S/C23H25N3O2/c27-23-13-18-12-19-20(25-28-22(19)14-21(18)24-23)7-6-16-8-10-26(11-9-16)15-17-4-2-1-3-5-17/h1-5,12,14,16H,6-11,13,15H2,(H,24,27)
InChIKey
MTCMTKNMZCPKLX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Icopezil
CAS: 145508-78-7
CID: 172972
Formula: C23H25N3O2
MW: 375.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight375.5
XLogP33.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass375.19467705
Monoisotopic Mass375.19467705
Topological Polar Surface Area58.4 Ų
Heavy Atom Count28
Formal Charge0
Complexity542
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

Alternative Products

CatalogName
MBS5810638Icopezil
T32134Icopezil maleate

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