Transcainide
Basic information
- CAS
88296-62-2- Standard SMILES
Cc1cccc(C)c1NC(=O)C1(N(C)C)CCN([C@@H]2CCCC[C@H]2O)CC1- InChIKey
MFKCGXDCHAFQQZ-RTBURBONSA-N- Molecular formula
- C22H35N3O2
- Average molar mass
- 373.5 g/mol
- Monoisotopic mass
- 373.27292737
Names & identifiers
- Preferred name
- Transcainide
- IUPAC
- 4-(dimethylamino)-N-(2,6-dimethylphenyl)-1-[(1R,2R)-2-hydroxycyclohexyl]piperidine-4-carboxamide
- English name
- Transcainide
- Molecular formula
- C22H35N3O2
- Molecular weight
- 373.53
Names & synonyms
Transcainide88296-62-2TranscainidaTranscainidum5VSP2X37QGR 54,7184-(dimethylamino)-N-(2,6-dimethylphenyl)-1-(2-hydroxycyclohexyl)-4-piperidinecarboxamideR-54718RefChem:9332894-(dimethylamino)-n-(2,6-dimethylphenyl)-1-[(1r,2r)-2-hydroxycyclohexyl]piperidine-4-carboxamideTranscainidum [Latin]Transcainida [Spanish]
Show more names
rel-(1R*)-2β*-[4-[(2,6-Dimethylphenyl)carbamoyl]-4-(dimethylamino)piperidino]1β*-cyclohexanol4-Piperidinecarboxamide, 4-(dimethylamino)-N-(2,6-dimethylphenyl)-1-[(1R,2R)-2-hydroxycyclohexyl]-,rel-
Transcainide [USAN:INN]R 54718UNII-5VSP2X37QGTranscainide (USAN/INN)TRANSCAINIDE [INN](+-)-trans-4-(Dimethylamino)-1-(2-hydroxycyclohexyl)-2',6'-isonipectoxylidideTRANSCAINIDE [USAN]TRANSCAINIDE [MART.]
Database identifiers
- CAS
88296-62-2- PubChem CID
- 68608
- ChEMBL
CHEMBL2218873- UNII
- 5VSP2X37QG
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 492
Physicochemical properties
- Boiling point
- 529.42 · 529.420±50.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.134 · 1.134±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 14.593 · 14.593±0.70(predicted)
- FDA UNII
- 5 VSP2X37QG · 5VSP2X37QG
Chemistry & industry
Applications
UsesTranscainide (R 54718) is an orally active antiarrhythmic agent[1].
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…