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Disopyramide phosphate

CAT: 0013-GTR19201721-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19201721-01Size:25 mg
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Description
Disopyramide is a Class 1a antiarrhythmic sodium channel blocker used to manage ventricular tachycardia. Its application in cardiovascular research includes studying its negative inotropic effects on myocardial contractility in both in vitro and in vivo experimental models.
CAS Number
22059-60-5
Field of Research
Pharmacology & Drug Discovery
Smiles
O=C (N) C (C1=NC=CC=C1) (C=2C=CC=CC2) CCN (C (C) C) C (C) C.O=P (O) (O) O
Molecular Formula
C21H32N3O5P
Molecular Weight
437.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Disopyramide Phosphate

Disopyramide phosphate is an organoammonium phosphate. It is functionally related to a disopyramide.

CAS Number22059-60-5
PubChem CID30928
IUPAC Name4-[di(propan-2-yl)amino]-2-phenyl-2-pyridin-2-ylbutanamide;phosphoric acid
Molecular FormulaC21H32N3O5P
Molecular Weight437.5
Topological Polar Surface Area137
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count30
Formal Charge0
Complexity459
SMILES
CC(C)N(CCC(C1=CC=CC=C1)(C2=CC=CC=N2)C(=O)N)C(C)C.OP(=O)(O)O
InChI
InChI=1S/C21H29N3O.H3O4P/c1-16(2)24(17(3)4)15-13-21(20(22)25,18-10-6-5-7-11-18)19-12-8-9-14-23-19;1-5(2,3)4/h5-12,14,16-17H,13,15H2,1-4H3,(H2,22,25);(H3,1,2,3,4)
InChIKey
CGDDQFMPGMYYQP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Disopyramide Phosphate
CAS: 22059-60-5
CID: 30928
Formula: C21H32N3O5P
MW: 437.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight437.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass437.20795813
Monoisotopic Mass437.20795813
Topological Polar Surface Area137 Ų
Heavy Atom Count30
Formal Charge0
Complexity459
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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