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Dexetimide

CAT: 0804-HY-105545-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-105545-02Size:10 mg
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Description
Dexetimide ((+) -Benzetimide; (S) - (+) -Dexetimide; Dexbenzetimide) is a piperidine anticholinergic and a high-affinity muscarinic receptor antagonist. Dexetimide can be used in studies of parkinson's disease[1][2].
CAS Number
21888-98-2
Product Name Alternative
(+) -Benzetimide; (S) - (+) -Dexetimide; Dexbenzetimide
UNSPSC
12352005
Target
MAChR
Type
Reference compound
Related Pathways
GPCR/G Protein; Neuronal Signaling
Applications
COVID-19-immunoregulation
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/dexetimide.html
Purity
99.94
Solubility
DMSO : ≥ 100 mg/mL
Smiles
O=C(N1)[C@@](C2CCN(CC3=CC=CC=C3)CC2)(C4=CC=CC=C4)CCC1=O
Molecular Formula
C23H26N2O2
Molecular Weight
362.46
References & Citations
[1]Speck AL, et al. The absolute configuration and crystal structure of the anticholinergic drug dexbenzetimide. Nature. 1971 Aug 20;232 (5312) :575-6.|[2]Müller-Gärtner HW, et al. Imaging muscarinic cholinergic receptors in human brain in vivo with Spect, [123I]4-iododexetimide, and [123I]4-iodolevetimide. J Cereb Blood Flow Metab. 1992 Jul;12 (4) :562-70.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Dexetimide

Dexetimide is a member of piperidines.

CAS Number21888-98-2
PubChem CID30843
IUPAC Name(3S)-3-(1-benzylpiperidin-4-yl)-3-phenylpiperidine-2,6-dione
Molecular FormulaC23H26N2O2
Molecular Weight362.5
XLogP3.1
Topological Polar Surface Area49.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity528
SMILES
C1CN(CCC1[C@@]2(CCC(=O)NC2=O)C3=CC=CC=C3)CC4=CC=CC=C4
InChI
InChI=1S/C23H26N2O2/c26-21-11-14-23(22(27)24-21,19-9-5-2-6-10-19)20-12-15-25(16-13-20)17-18-7-3-1-4-8-18/h1-10,20H,11-17H2,(H,24,26,27)/t23-/m1/s1
InChIKey
LQQIVYSCPWCSSD-HSZRJFAPSA-N
Chemical Structure
2D Structure
2D structure of Dexetimide
CAS: 21888-98-2
CID: 30843
Formula: C23H26N2O2
MW: 362.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight362.5
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass362.199428076
Monoisotopic Mass362.199428076
Topological Polar Surface Area49.4 Ų
Heavy Atom Count27
Formal Charge0
Complexity528
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T15104-01Dexetimide
A19267-100Dexetimide 100mg
A19267-10Dexetimide 10mg
MBS5812370Dexetimide HCl
A19267-25Dexetimide 25mg
A19267-5Dexetimide 5mg
A19267-50Dexetimide 50mg
A19267-2Dexetimide 2mg
A19267-10mM-DDexetimide 10mM * 1mL in DMSO

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