Molecular Identity
Propafenone
1-[2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one
PubChem CID: 4932
Propafenone is an aromatic ketone that is 3-(propylamino)propane-1,2-diol in which the hydrogen of the primary hydroxy group is replaced by a 2-(3-phenylpropanoyl)phenyl group. It is a class 1C antiarrhythmic drug with local anesthetic effects, and is used as the hydrochloride salt in the management of supraventricular and ventricular arrhythmias. It has a role as an anti-arrhythmia drug. It is a secondary alcohol, a secondary amino compound and an aromatic ketone. It is a conjugate base of a propafenone(1+).
2D Structure
Properties
C21H27NO3
Molecular Formula
341.40
Molecular Weight
g/mol
341.1991
Exact Mass
Da
3.3
XLogP
Drug-like (Lipinski: < 5)
58.6
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
4
H-Bond Acceptors
368
Complexity
SMILES
Canonical SMILES
SMILES: CCCNCC(COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)OIsomeric SMILES
SMILES: CCCNCC(COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)OSynonyms(20)
propafenone54063-53-5PropafenonaPropafenonum1-(2-(2-hydroxy-3-(propylamino)propoxy)phenyl)-3-phenylpropan-1-onePropafenon HexalGNF-Pf-4594DTXSID90451841-(2-(2-Hydroxy-3-(propylamino)propoxy)phenyl)-3-phenyl-1-propanone1-[2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one68IQX3T69U1-{2-[2-hydroxy-3-(propylamino)propoxy]phenyl}-3-phenylpropan-1-oneDTXCID7025184CHEBI:636191-Propanone, 1-(2-(2-hydroxy-3-(propylamino)propoxy)phenyl)-3-phenyl-
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Propafenone
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