Basic information
- CAS
81447-80-5- Standard SMILES
CCC(C)(C)NCC(O)COc1ccccc1C(=O)CCc1ccccc1- InChIKey
VDKMYSMWQCFYBQ-UHFFFAOYSA-N- Molecular formula
- C23H31NO3
- Average molar mass
- 369.5 g/mol
- Monoisotopic mass
- 369.23039385
Overview
Diprafenone is an aromatic compound.
Names & identifiers
- Preferred name
- Diprafenone
- IUPAC
- 1-[2-[2-hydroxy-3-(2-methylbutan-2-ylamino)propoxy]phenyl]-3-phenylpropan-1-one
- English name
- Diprafenone
- Molecular formula
- C23H31NO3
- Molecular weight
- 369.5
Names & synonyms
Diprafenone81447-80-5DiprafenonaDiprafenonum1P35MD5C1F(+-)-2'-(2-Hydroxy-3-(tert-pentylamino)propoxy)-3-phenylpropiophenoneRefChem:920441Diprafenone [INN]1-[2-[2-hydroxy-3-(2-methylbutan-2-ylamino)propoxy]phenyl]-3-phenylpropan-1-one1-[2-[2-hydroxy-3-(2-methylbutan-2-ylamino)propoxy]phenyl]-3-phenyl-propan-1-oneDiprafenonum [Latin]Diprafenona [Spanish]
Show more names
Diprafenone Free Base
UNII-1P35MD5C1FDTXSID10868613(+/-)-DiprafenoneDIPRAFENONE [WHO-DD]85414-47-7SCHEMBL563653CHEMBL441809orb1740832
Database identifiers
- CAS
81447-80-5、85414-47-7- PubChem CID
- 71249
- DTXSID
DTXSID10868613- ChEMBL
CHEMBL441809- ChEBI
CHEBI:135559- UNII
- 1P35MD5C1F
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 431
Physicochemical properties
- Boiling point
- 530.6 · 530.6±50.0 °C(Predicted)
- Density
- 1.072 · 1.072±0.06 g/cm3(Predicted)
- pka
- 13.82 · 13.82±0.20(Predicted)
- FDA UNII
- 1 P35MD5C1F · 1P35MD5C1F
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Agents used for the treatment or prevention of cardiac arrhythmias. They may affect the polarization-repolarization phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibers. Anti-arrhythmia agents are often classed into four main groups according to their mechanism of action: sodium channel blockade, beta-adrenergic blockade, repolarization prolongation, or calcium channel blockade.
Additional notes
DefinitionChEBI: Diprafenone is an aromatic compound.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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