Ethamon DS
diethyl-methyl-[[3-[[methyl(diphenyl)azaniumyl]methyl]-2-oxoimidazolidin-1-yl]methyl]azanium sulfate
Also Known As: Ethamon DS|Etamon DS|(S-Dinitrophenyl)-6-mercaptopurine riboside triphosphate|1,3-Imidazolidinedimethanaminium, N,N-diethyl-N,N'-dimethyl-2-oxo-N',N'-diphenyl-, sulfate (1:1)|n-[(3-{[diethyl(methyl)ammonio]methyl}-2-oxoimidazolidin-1-yl)methyl]-n-methyl-n-phenylanilinium sulfate|1,3-Imidazolidinedimethanaminium, N1,N1-diethyl-N1,N3-dimethyl-2-oxo-N3,N3-diphenyl-, sulfate (1:1)|diethyl-methyl-[[3-[[methyl(diphenyl)azaniumyl]methyl]-2-oxoimidazolidin-1-yl]methyl]azanium sulfate|N-[(3-{[Diethyl(methyl)azaniumyl]methyl}-2-oxoimidazolidin-1-yl)methyl]-N-methyl-N-phenylanilinium sulfate
| Molecular Formula | C23H34N4O5S |
|---|---|
| Molecular Weight | 478.225 g/mol |
| LogP | 2.7564 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 478.225 |
| Monoisotopic Mass | 478.225 |
| Heavy Atoms | 33 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 66565-48-8 |
|---|---|
| SMILES | CC[N+](C)(CC)CN1CCN(C1=O)C[N+](C)(C2=CC=CC=C2)C3=CC=CC=C3.[O-]S(=O)(=O)[O-] |
| InChIKey | LKRXSRWUDJCBJR-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethamon DS (CAS 66565-48-8), with molecular formula C23H34N4O5S and molecular weight 478.225 g/mol. IUPAC: diethyl-methyl-[[3-[[methyl(diphenyl)azaniumyl]methyl]-2-oxoimidazolidin-1-yl]methyl]azanium sulfate.
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