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Azaperol-D4

CAT: 0013-GTR19237284-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19237284-02Size:500 mg
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Description
Azaperone-d4 is the deuterium labeled Azaperone. Azaperone (R-1929) acts as a dopamine antagonist but also has some antihistaminic and anticholinergic properties. Azaperone is a pyridinylpiperazine and butyrophenone neuroleptic agent with antiemetic effects, which is used mainly as a tranquilizer in veterinary medicine.Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs.
CAS Number
1173021-72-1
Product Name Alternative
R-1929-d4
Purity
>98% (HPLC)
Smiles
O=C (C1=C ([2H]) C ([2H]) =C (C ([2H]) =C1[2H]) F) CCCN2CCN (C3=CC=CC=N3) CC2
Molecular Formula
C19H18D4FN3O
Molecular Weight
331.42
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Azaperone-d4
CAS Number1173021-72-1
PubChem CID71312466
IUPAC Name4-(4-pyridin-2-ylpiperazin-1-yl)-1-(2,3,5,6-tetradeuterio-4-fluorophenyl)butan-1-one
Molecular FormulaC19H22FN3O
Molecular Weight331.4
XLogP3.3
Topological Polar Surface Area36.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity390
SMILES
[2H]C1=C(C(=C(C(=C1C(=O)CCCN2CCN(CC2)C3=CC=CC=N3)[2H])[2H])F)[2H]
InChI
InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2/i6D,7D,8D,9D
InChIKey
XTKDAFGWCDAMPY-YKVCKAMESA-N
Chemical Structure
2D Structure
2D structure of Azaperone-d4
CAS: 1173021-72-1
CID: 71312466
Formula: C19H22FN3O
MW: 331.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight331.4
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass331.19979748
Monoisotopic Mass331.19979748
Topological Polar Surface Area36.4 Ų
Heavy Atom Count24
Formal Charge0
Complexity390
Isotope Atom Count4
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
FA183711-01Azaperol-D4
TRC-A802190-25MGAzaperol
CS-O-135655-Hydroxy-azaperol
CS-T-93301Sonidegib-d4 (Morphonyl-d4)
CS-O-62346Paliperidone-d4 (Piperidin-d4)
CS-T-84109Pioglitazone-d4 (ethyl-d4)
CS-O-06425Atovaquone-d4 (Naphthalene-d4)
C184626(±)-Carvedilol-d4 (ethyl-d4)
CS-T-94093Safinamide-D4 (Alanine-D4)
CS-O-06657Haloperidol-d4[Fluorophenyl-d4]

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