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Pentisomide

CAT: 0931-T25934-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T25934-01Size:25 mg
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CAS Number
78833-03-1
Target
Others, Sodium Channel
Related Pathways
Others, Membrane transporter/Ion channel
Bioactivity
Pentisomide is a class-I antiarrhythmic agent with a marked effect on depolarization (action of class Ia and Ic) and on repolarization. Pentisomide dose-dependently inhibited ischaemia-reperfusion arrhythmia. Pentisomide had been in phase II clinical trial for the treatment of arrhythmias.
Smiles
C(CCN(C(C)C)C(C)C)(CC(C)C)(C(N)=O)C1=CC=CC=N1
Molecular Formula
C19H33N3O
Molecular Weight
319.48
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

alpha-(2-(Bis(1-methylethyl)amino)ethyl)-alpha-(2-methylpropyl)-2-pyridineacetamide
CAS Number78833-03-1
PubChem CID65847
IUPAC Name2-[2-[di(propan-2-yl)amino]ethyl]-4-methyl-2-pyridin-2-ylpentanamide
Molecular FormulaC19H33N3O
Molecular Weight319.5
XLogP3.2
Topological Polar Surface Area59.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count9
Heavy Atom Count23
Formal Charge0
Complexity360
SMILES
CC(C)CC(CCN(C(C)C)C(C)C)(C1=CC=CC=N1)C(=O)N
InChI
InChI=1S/C19H33N3O/c1-14(2)13-19(18(20)23,17-9-7-8-11-21-17)10-12-22(15(3)4)16(5)6/h7-9,11,14-16H,10,12-13H2,1-6H3,(H2,20,23)
InChIKey
ZZOZYGHXNQPIPS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of alpha-(2-(Bis(1-methylethyl)amino)ethyl)-alpha-(2-methylpropyl)-2-pyridineacetamide
CAS: 78833-03-1
CID: 65847
Formula: C19H33N3O
MW: 319.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight319.5
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count9
Exact Mass319.262362685
Monoisotopic Mass319.262362685
Topological Polar Surface Area59.2 Ų
Heavy Atom Count23
Formal Charge0
Complexity360
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
286723Pentisomide
sc-219570Pentisomide-d4
sc-208025DN-Desisopropyl Pentisomide
TRC-D195663-25MGDeacetamide Acetonitrile-pentisomide
P3236-30Pentisomide (a-[2-[Bis (1-methylethyl) amino]ethyl]-a- (2-methylpropyl) -2-pyridineacetamide, _x000B_2-[2- (Diisopropylamino) ethyl]-4-methyl]-2- (2-pyridyl) pentanamide, Propisomide, Penticainide, CM-7857, ME-3202)
MBS6032738-01Pentisomide (a-[2-[Bis(1-methylethyl)amino]ethyl]-a-(2-methylpropyl)-2-pyridineacetamide,2-[2-(Diisopropylamino)ethyl]-4-methyl]-2-(2-pyridyl)pentanamide, Propisomide, Penticainide, CM-7857, ME-3202)
MBS6074174-01Pentisomide-d4 (a-[2-[Bis(1-methylethyl)amino]ethyl]-a-(2-methylpropyl)-2-pyridineacetamide-d4,2-[2-(Diisopropylamino)ethyl]-4-methyl]-2-(2-pyridyl)pentanamide-d4, Propisomide-d4, Penticainide-d4, CM-7857-d4, ME-3202-d4)
P3236-30DPentisomide-d4 (a-[2-[Bis (1-methylethyl) amino]ethyl]-a- (2-methylpropyl) -2-pyridineacetamide-d4, _x000B_2-[2- (Diisopropylamino) ethyl]-4-methyl]-2- (2-pyridyl) pentanamide-d4, Propisomide-d4, Penticainide-d4, CM-7857-d4, ME-3202-d4)

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