N-(4-benzylsulfanyl-5-nitro-6-oxo-1H-pyrimidin-2-yl)acetamide
N-(4-benzylsulfanyl-5-nitro-6-oxo-1H-pyrimidin-2-yl)acetamide
Also Known As: N-(4-benzylsulfanyl-5-nitro-6-oxo-1H-pyrimidin-2-yl)acetamide|n-[4-(benzylsulfanyl)-5-nitro-6-oxo-1,6-dihydropyrimidin-2-yl]acetamide
CAS: 22604-10-0
| Molecular Formula | C13H12N4O4S |
|---|---|
| Molecular Weight | 320.05792 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.05792 |
| Monoisotopic Mass | 320.05792 |
| Heavy Atoms | 22 |
| Complexity | 547.0 |
Chemical Identifiers
| CAS Number | 22604-10-0 |
|---|---|
| SMILES | CC(=O)NC1=NC(=C(C(=O)N1)[N+](=O)[O-])SCC2=CC=CC=C2 |
| InChIKey | AKUOIRZWRLSYEA-UHFFFAOYSA-N |
Product Overview
N-(4-benzylsulfanyl-5-nitro-6-oxo-1H-pyrimidin-2-yl)acetamide (CAS 22604-10-0), with molecular formula C13H12N4O4S and molecular weight 320.05792 g/mol. IUPAC: N-(4-benzylsulfanyl-5-nitro-6-oxo-1H-pyrimidin-2-yl)acetamide.
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 →
N-(4-benzylsulfanyl-5-nitro-6-oxo-1H-pyrimidin-2-yl)acetamide is a custom synthesis product. We offer services from milligram to kilogram scale.
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