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Midaglizole hydrochloride

CAT: 0013-GTR19206061-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19206061-01Size:1 mg
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Description
Midaglizole hydrochloride (DG5128) is a selective α2-adrenoceptor antagonist with a 7.4-fold higher affinity for α2- versus α1-adrenoceptors (pKi = 6.28) . It is utilized in pharmacological research to study adrenergic signaling in both in vitro binding assays and in vivo models of cardiovascular and sympathetic nervous system function.
CAS Number
79689-25-1
Product Name Alternative
DG5128 hydrochloride, DG-5128 Hydrochloride, DG 5128 Hydrochloride, (±) -DG5128 hydrochloride, Adrenergic Receptor, AdrenergicReceptor, Midaglizole Hydrochloride, α2-adrenoceptor
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Purity
99.27% (May vary between batches)
Solubility
DMSO:45 mg/mL (138.78 mM)
Smiles
C1 (C (CC2=NCCN2) C3=CC=CC=C3) =NC=CC=C1.Cl.Cl
Molecular Formula
C16H19Cl2N3
Molecular Weight
324.25
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Midaglizole dihydrochloride
CAS Number79689-25-1
PubChem CID157562
IUPAC Name2-[2-(4,5-dihydro-1H-imidazol-2-yl)-1-phenylethyl]pyridine;dihydrochloride
Molecular FormulaC16H19Cl2N3
Molecular Weight324.2
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count21
Formal Charge0
Complexity307
SMILES
C1CN=C(N1)CC(C2=CC=CC=C2)C3=CC=CC=N3.Cl.Cl
InChI
InChI=1S/C16H17N3.2ClH/c1-2-6-13(7-3-1)14(12-16-18-10-11-19-16)15-8-4-5-9-17-15;;/h1-9,14H,10-12H2,(H,18,19);2*1H
InChIKey
PAKRIOPMNVCTCL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Midaglizole dihydrochloride
CAS: 79689-25-1
CID: 157562
Formula: C16H19Cl2N3
MW: 324.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight324.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass323.0956030
Monoisotopic Mass323.0956030
Topological Polar Surface Area37.3 Ų
Heavy Atom Count21
Formal Charge0
Complexity307
Isotope Atom Count0
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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