Propafenone, (S)-
1-[2-[(2S)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one
Molecular Identity
Propafenone, (S)-
1-[2-[(2S)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one
PubChem CID: 184820
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: CCCNC[C@@H](COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)OSynonyms(20)
(S)-Propafenone107381-32-8(-)-Propafenone(-)-(S)-PropafenonePropafenone, (S)-N0BQN4E2YT1-[2-[(2S)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one1-{2-[(2S)-2-HYDROXY-3-(PROPYLAMINO)PROPOXY]PHENYL}-3-PHENYLPROPAN-1-ONE1-(2-((2S)-2-hydroxy-3-(propylamino)propoxy)phenyl)-3-phenylpropan-1-oneRefChem:1966021-[2-[(2S)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-1-propanoneUNII-N0BQN4E2YT(S)-SA-791-Propanone, 1-[2-[(2S)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-; 1-Propanone, 1-[2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-, (S)-; 1-[2-[(2S)-2-Hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-1-propanone; (-)-(S)-Propafenone; (-)-Propafenone; (S)-PropafenoneMFCD00869668
Data from PubChem (NCBI)
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