Bunaftine
Basic information
- CAS
32421-46-8- Standard SMILES
CCCCN(CCN(CC)CC)C(=O)c1cccc2ccccc12- InChIKey
WWGZXRYELYWJBD-UHFFFAOYSA-N- Molecular formula
- C21H30N2O
- Average molar mass
- 326.5 g/mol
- Monoisotopic mass
- 326.23581359
Overview
Bunaftine is a naphthalenecarboxamide.
Names & identifiers
- Preferred name
- Bunaftine
- IUPAC
- N-butyl-N-[2-(diethylamino)ethyl]naphthalene-1-carboxamide
- English name
- bunaftine
- Molecular formula
- C21H30N2O
- Molecular weight
- 326.48
Names & synonyms
BunaftineBunaftide32421-46-8BunaphtideBunaphtineBunaftinaBunaftinumN-butyl-N-[2-(diethylamino)ethyl]naphthalene-1-carboxamideGH09PRQ3FUN-Butyl-N-(2-(diethylamino)ethyl)-1-naphthamideDTXSID901861651-NAPHTHALENECARBOXAMIDE, N-BUTYL-N-(2-(DIETHYLAMINO)ETHYL)-
Show more names
MeregonBunaphtide|||Meregon|||BunaftineN-Butyl-N-[2-(diethylamino)ethyl]-1-naphthalenecarboxamide1-Naphthalenecarboxamide, N-butyl-N-[2-(diethylamino)ethyl]-
N-butyl-N-(2-(diethylamino)ethyl)naphthalene-1-carboxamideRefChem:121898C01BD03DTXCID00108656251-027-1Bunaftine [INN]Bunaftine; Bunaphtide; MeregonBunaftine (INN)
Database identifiers
- CAS
32421-46-8- PubChem CID
- 36131
- DTXSID
DTXSID90186165- ChEMBL
CHEMBL2104200- ChEBI
CHEBI:135392- UNII
- GH09PRQ3FU
- EC Number
- 251-027-1
- Nikkaji
- J19.759I
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 367
Physicochemical properties
- Boiling point
- 0.1 · bp0.1 178°
- storage temp.
- -20 °C · Store at -20°C
- solubility
- Soluble in DMSO
- FDA UNII
- 9 PRQ3FU · GH09PRQ3FU
- ATC code
- 1 BD03 · C01BD03
- Toxicity
- 50 i.p · LD50 i.p. in mice: 122 mg/kg (Giannini et al.)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LD50 i.p. in mice: 122 mg/kg (Giannini et al.)
Chemistry & industry
Pharmacology
ATC Code
C - Cardiovascular system
QC - Cardiovascular system
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.
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: Bunaftine is a naphthalenecarboxamide.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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