RefChem:1092110
[3-(tert-butylcarbamoyl)-4-oxidoquinoxalin-4-ium-2-yl]methyl N'-hydroxycarbamimidothioate;hydrochloride
Also Known As: Pseudourea, 2-((3-(tert-butylcarbamoyl)-2-quinoxalinyl)methyl)-2-thio-, 1,4-dioxide, monohydrochloride|N-tert-Butyl-3-(((N-hydroxycarbamimidoyl)sulfanyl)methyl)-1-oxo-1lambda~5~-quinoxaline-2-carboximidic acid--hydrogen chloride (1/1)
CAS: 23765-90-4
| Molecular Formula | C15H20ClN5O3S |
|---|---|
| Molecular Weight | 385.09753 g/mol |
| LogP | 1.7554 |
| Topological Polar Surface Area | 127.54 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 385.09753 |
| Monoisotopic Mass | 385.09753 |
| Heavy Atoms | 25 |
| Complexity | 807.5888 |
Chemical Identifiers
| CAS Number | 23765-90-4 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=[N+](C2=CC=CC=C2N=C1CS/C(=N/O)/N)[O-].Cl |
Product Overview
RefChem:1092110 (CAS 23765-90-4), with molecular formula C15H20ClN5O3S and molecular weight 385.09753 g/mol. IUPAC: [3-(tert-butylcarbamoyl)-4-oxidoquinoxalin-4-ium-2-yl]methyl N'-hydroxycarbamimidothioate;hydrochloride.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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