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Hydroxyzine-d8 (dihydrochloride)

CAT: 0804-HY-B0548AS2Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-B0548AS2Size:1 mg
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Description
Hydroxyzine-d8 (dihydrochloride) is the deuterium labeled Hydroxyzine dihydrochloride. Hydroxyzine dihydrochloride, a benzodiazepine antihistamine agent, acts as a orally active histamine?H1-receptor and serotonin antagonist. Hydroxyzine dihydrochloride has anxiolytic effect and can be used forthe research of generalised anxiety disorder[1][2].
CAS Number
1808202-93-8
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
Histamine Receptor; Isotope-Labeled Compounds
Type
Isotope-Labeled Compounds
Related Pathways
GPCR/G Protein; Immunology/Inflammation; Neuronal Signaling; Others
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Inflammation/Immunology; Endocrinology
Solubility
10 mM in DMSO
Smiles
OCCOCCN(C([2H])([2H])C1([2H])[2H])C([2H])([2H])C([2H])([2H])N1C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl.Cl
Molecular Formula
C21H21D8Cl3N2O2
Molecular Weight
455.88
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53 (2) :211-216.|[2]Minogiannis, P., et al., Hydroxyzine inhibits neurogenic bladder mast cell activation. Int J Immunopharmacol, 1998. 20 (10) : p. 553-63.|[3]Nikita Shekhar Sawantdesai, et al. Evaluation of anxiolytic effects of aripiprazole and hydroxyzine as a combination in mice. J Basic Clin Pharm. 2016 Sep;7 (4) :97-104.
Shipping Conditions
Room temperature
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported
Isoform
H1 Receptor

Chemical Information

Hydroxyzine-d8.2HCl
CAS Number1808202-93-8
PubChem CID76973481
IUPAC Name2-[2-[4-[(4-chlorophenyl)-phenylmethyl]-2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl]ethoxy]ethanol;dihydrochloride
Molecular FormulaC21H29Cl3N2O2
Molecular Weight455.9
Topological Polar Surface Area35.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count28
Formal Charge0
Complexity376
SMILES
[2H]C1(C(N(C(C(N1CCOCCO)([2H])[2H])([2H])[2H])C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)([2H])[2H])[2H].Cl.Cl
InChI
InChI=1S/C21H27ClN2O2.2ClH/c22-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)24-12-10-23(11-13-24)14-16-26-17-15-25;;/h1-9,21,25H,10-17H2;2*1H/i10D2,11D2,12D2,13D2;;
InChIKey
ANOMHKZSQFYSBR-FLZNRFFQSA-N
Chemical Structure
2D Structure
2D structure of Hydroxyzine-d8.2HCl
CAS: 1808202-93-8
CID: 76973481
Formula: C21H29Cl3N2O2
MW: 455.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight455.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass454.179675
Monoisotopic Mass454.179675
Topological Polar Surface Area35.9 Ų
Heavy Atom Count28
Formal Charge0
Complexity376
Isotope Atom Count8
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
CS-SN-00041Hydroxyzine-d8 Dihydrochloride
TMIH-0272-01Hydroxyzine dihydrochloride-d8
FH24516-01Hydroxyzine dihydrochloride
TMIH-0273-01Hydroxyzine dihydrochloride-d10
CS-O-06666Hydroxyzine-d4 Dihydrochloride
RM-H250427-01Hydroxyzine D4 Dihydrochloride
TMIH-0271-01Hydroxyzine dihydrochloride-d4
TRC-H997000-50MGHydroxyzine Acetic Acid Dihydrochloride
H9132-01Hydroxyzine-d8 Dihydrochloride (2-[2-[4-[ (4-Chlorophenyl) -phenylmethyl]-1-piperazinyl-d8]ethoxy]ethanol Dihydrochloride, Alamon-d8, Atarax-d8, Aterax-d8, Durrax-d8, Orgatrax-d8, Quiess-d8)
MBS6068375-01Hydroxyzine-d8 Dihydrochloride (2-[2-[4-[(4-Chlorophenyl)-phenylmethyl]-1-piperazinyl-d8]ethoxy]ethanol Dihydrochloride, Alamon-d8, Atarax-d8, Aterax-d8, Durrax-d8, Orgatrax-d8, Quiess-d8)

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