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Eltoprazine hydrochloride

CAT: 0013-GTR19160612-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19160612-01Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
An antiaggressive agent that acts as an agonist at the 5-HT1A and 5-HT1B receptors and as an antagonist at the 5-HT2C receptor.Schizophrenia Phase 2 Clinical.
CAS Number
98206-09-8
Product Name Alternative
DU-28853 hydrochloride
Purity
>98% (HPLC)
Solubility
DMSO: ≥ 31 mg/mL; H2O: ≥ 28 mg/mL
Smiles
C1CN (CCN1) C2=C3C (=CC=C2) OCCO3
Molecular Formula
C12H17ClN2O2
Molecular Weight
256.7286
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
Piperazine, 1- (2,3-dihydro-1,4-benzodioxin-5-yl) -, hydrochloride (1:1)

Chemical Information

Eltoprazine hydrochloride
CAS Number98206-09-8
PubChem CID3025067
IUPAC Name1-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine;hydrochloride
Molecular FormulaC12H17ClN2O2
Molecular Weight256.73
Topological Polar Surface Area33.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity231
SMILES
C1CN(CCN1)C2=C3C(=CC=C2)OCCO3.Cl
InChI
InChI=1S/C12H16N2O2.ClH/c1-2-10(14-6-4-13-5-7-14)12-11(3-1)15-8-9-16-12;/h1-3,13H,4-9H2;1H
InChIKey
JFSOSUNPIXJCIX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Eltoprazine hydrochloride
CAS: 98206-09-8
CID: 3025067
Formula: C12H17ClN2O2
MW: 256.73
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight256.73
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass256.0978555
Monoisotopic Mass256.0978555
Topological Polar Surface Area33.7 Ų
Heavy Atom Count17
Formal Charge0
Complexity231
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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