Products for Research Use Only

Benperidol

CAT: 0013-GTR19198497-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19198497-07Size:100 mg
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Description
Benperidol (Anquil) is a butanone-derived antipsychotic agent that acts as a potent D2 dopamine receptor antagonist. It serves as a valuable tool in neuroscience research, particularly for in vivo PET imaging studies to quantify D2 receptor occupancy and for in vitro binding assays investigating dopaminergic pathways.
CAS Number
2062-84-2
Product Name Alternative
McN-JR 4584, McN-JR4584, McN-JR-4584, Anquil, Benperidol, D2 receptor, Dopamine Receptor, DopamineReceptor, R4584, R-4584, R 4584
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Purity
97.39% (May vary between batches)
Solubility
DMSO:90 mg/mL (235.95 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (5.24 mM)
Smiles
O=C1N (C=2C (N1) =CC=CC2) C3CCN (CCCC (=O) C4=CC=C (F) C=C4) CC3
Molecular Formula
C22H24FN3O2
Molecular Weight
381.44
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Benperidol

3-[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]-1H-benzimidazol-2-one is an aromatic ketone.

CAS Number2062-84-2
PubChem CID16363
IUPAC Name3-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-1H-benzimidazol-2-one
Molecular FormulaC22H24FN3O2
Molecular Weight381.4
XLogP3.7
Topological Polar Surface Area52.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count28
Formal Charge0
Complexity556
SMILES
C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCCC(=O)C4=CC=C(C=C4)F
InChI
InChI=1S/C22H24FN3O2/c23-17-9-7-16(8-10-17)21(27)6-3-13-25-14-11-18(12-15-25)26-20-5-2-1-4-19(20)24-22(26)28/h1-2,4-5,7-10,18H,3,6,11-15H2,(H,24,28)
InChIKey
FEBOTPHFXYHVPL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benperidol
CAS: 2062-84-2
CID: 16363
Formula: C22H24FN3O2
MW: 381.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight381.4
XLogP33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass381.18525518
Monoisotopic Mass381.18525518
Topological Polar Surface Area52.7 Ų
Heavy Atom Count28
Formal Charge0
Complexity556
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