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Chemical structure of Modecainide (BMY 40327)

GC32535

Modecainide (BMY 40327)

Also known as 4-hydroxy-3-methoxy-N-[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl]benzamide

Modecainide (BMY 40327) is a major metabolite of Encainide, which is an antiarrhythmic agent

ChemicalCAS81329-71-7MW368.47FormulaC22H28N2O3
CAS number
81329-71-7
Molecular weight
368.47
Formula
C22H28N2O3
Solubility
Methanol ： ≥ 250 mg/mL (678·48 mM); DMSO ： 100 mg/mL (271·39 mM; Need ultrasonic)
InChIKey
LBYXPDAENJSHDD-UHFFFAOYSA-N
Catalogue number
GC32535
Brand
GLPBIO
Computed properties PubChem CID 54737 · XLogP 3.9 · TPSA 61.8 Ų · H-bond donors 2
XLogP
3.9
TPSA
61.8 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
27

SMILES CN1CCCCC1CCC2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)O)OC

Computed descriptors from PubChem (CID 54737), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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