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Decloxizine (Standard)

CAT: 0804-HY-17582RSize: 1 EachDry Ice: NoHazardous: No
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Description
Decloxizine (Standard) is the analytical standard of Decloxizine. This product is intended for research and analytical applications. 0
CAS Number
3733-63-9
Product Name Alternative
UCB-1402 (Standard) ; NSC289116 (Standard)
UNSPSC
12352005
Target
Histamine Receptor; Reference Standards
Type
Reference Standards
Related Pathways
GPCR/G Protein; Immunology/Inflammation; Neuronal Signaling; Others
Field of Research
Inflammation/Immunology; Endocrinology
Assay Protocol
https://www.medchemexpress.com/decloxizine-standard.html
Smiles
OCCOCCN1CCN(C(C2=CC=CC=C2)C3=CC=CC=C3)CC1
Molecular Formula
C21H28N2O2
Molecular Weight
340.46
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Decloxizine

Decloxizine is a small molecule drug. Decloxizine has a monoisotopic molecular weight of 340.22 Da.

CAS Number3733-63-9
PubChem CID71135
IUPAC Name2-[2-(4-benzhydrylpiperazin-1-yl)ethoxy]ethanol
Molecular FormulaC21H28N2O2
Molecular Weight340.5
XLogP3.1
Topological Polar Surface Area35.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count25
Formal Charge0
Complexity328
SMILES
C1CN(CCN1CCOCCO)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C21H28N2O2/c24-16-18-25-17-15-22-11-13-23(14-12-22)21(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-10,21,24H,11-18H2
InChIKey
OXBBIHZWNDPBMQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Decloxizine
CAS: 3733-63-9
CID: 71135
Formula: C21H28N2O2
MW: 340.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight340.5
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass340.215078140
Monoisotopic Mass340.215078140
Topological Polar Surface Area35.9 Ų
Heavy Atom Count25
Formal Charge0
Complexity328
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