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Arpromidine

CAT: 0013-GTR19250431-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19250431-01Size:10 mg
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Description
Arpromidine (BU-E-50) is a dual-activity small molecule, functioning as a histamine H2 receptor agonist and an H1 receptor antagonist. Its positive inotropic effect, associated with a reduced arrhythmogenic risk, makes it a relevant tool for in vitro and in vivo cardiovascular research, particularly in models of congestive heart failure.
CAS Number
106669-71-0
Field of Research
Immunology & Inflammation, Neuroscience, Pharmacology & Drug Discovery
Smiles
FC1=CC=C (C=C1) C (C2=NC=CC=C2) CCNC (=N) NCCCC3=CN=CN3
Molecular Formula
C21H25FN6
Molecular Weight
380.462
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Arpromidine

structure given in first source

CAS Number106669-71-0
PubChem CID65895
IUPAC Name1-[3-(4-fluorophenyl)-3-pyridin-2-ylpropyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
Molecular FormulaC21H25FN6
Molecular Weight380.5
XLogP2.4
Topological Polar Surface Area92
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Heavy Atom Count28
Formal Charge0
Complexity466
SMILES
C1=CC=NC(=C1)C(CCNC(=NCCCC2=CN=CN2)N)C3=CC=C(C=C3)F
InChI
InChI=1S/C21H25FN6/c22-17-8-6-16(7-9-17)19(20-5-1-2-11-25-20)10-13-27-21(23)26-12-3-4-18-14-24-15-28-18/h1-2,5-9,11,14-15,19H,3-4,10,12-13H2,(H,24,28)(H3,23,26,27)
InChIKey
KZZIVOLMJPSDEP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Arpromidine
CAS: 106669-71-0
CID: 65895
Formula: C21H25FN6
MW: 380.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight380.5
XLogP32.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Exact Mass380.21247299
Monoisotopic Mass380.21247299
Topological Polar Surface Area92 Ų
Heavy Atom Count28
Formal Charge0
Complexity466
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-164430Arpromidine

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