|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
43
Total Number of Articles : 98
|
| PubChem |
71329
|
| Molecular Formula |
C19H27N3O5S2 |
| SMILES |
CN(CCC1=CC=C(C=C1)NS(=O)(=O)C)CCOC2=CC=C(C=C2)NS(=O)(=O)C |
| InChI |
InChI=1S/C19H27N3O5S2/c1-22(13-12-16-4-6-17(7-5-16)20-28(2,23)24)14-15-27-19-10-8-18(9-11-19)21-29(3,25)26/h4-11,20-21H,12-15H2,1-3H3 |
| synonyms |
- Dofetilide
- 115256-11-6
- Tikosyn
- Dofetilida
- Dofetilidum
- UK 68798
- Dofetilidum [INN-Latin]
- Dofetilida [INN-Spanish]
- UK-68,798
- UK-68798
- N-(4-(2-(methyl(2-(4-(methylsulfonamido)phenoxy)ethyl)amino)ethyl)phenyl)methanesulfonamide
- UNII-R4Z9X1N2ND
- R4Z9X1N2ND
- beta-((p-Methanesulfonamidophenethyl)methylamino)methanesulfono-p-phenetidide
- CHEBI:4681
- Dofetilide (Tikosyn)
- Methanesulfonamide, N-[4-[2-[methyl[2-[4-[(methylsulfonyl)amino]phenoxy]ethyl]amino]ethyl]phenyl]-
- DTXSID5046433
- HSDB 7927
- CHEMBL473
- N-[4-[2-[2-[4-(methanesulfonamido)phenoxy]ethyl-methylamino]ethyl]phenyl]methanesulfonamide
- DTXCID3026433
- Dofetilide [USAN:USP:INN:BAN]
- MFCD00869707
- 1-(4-Methanesulphonamidophenoxy)-2-[N-(4-methanesulphonamidophenethyl)-N-methylamino]ethane
- N-[4-[2-[Methyl[2-[4-[(methylsulfonyl)amino]phenoxy]ethyl]amino]ethyl]phenyl]methanesulfonamide
- Methanesulfonamide, N-(4-(2-(methyl(2-(4-((methylsulfonyl)amino)phenoxy)ethyl)amino)ethyl)phenyl)-
- NCGC00164549-01
- Dofetilide (>90%)
- Dofetilidum (INN-Latin)
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|
| Properties |
| Property |
Value |
| MW |
441.6 g/mol |
| HBD |
2 |
| HBA |
8 |
| Rotatable Bond Count |
11 |
| Exact Mass |
441.13921332 g/mol |
| Monoisotopic Mass |
441.13921332 g/mol |
| Heavy Atom Count |
29 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
672 |
| xlogp |
1.8 |
| Topological Polar Surface Area |
122 |
|