-
Antiviral API
- Arenavirus
- Cytomegalovirus (CMV)
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- Endogenous Metabolite
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- West Nile virus
- Antiviral intermediates
5-Nitrobarbituric acid hydrate
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| Category | Herpes simplex Virus (HSV) |
| CAS | 209529-81-7 |
| Description | 5-Nitrobarbituric acid is a herpes simplex virus type-1 (HSV-1) inhibitor (IC50=1.7 μM). |
Product Information
| Synonyms | 5-nitro-1,3-diazinane-2,4,6-trione;hydrate |
| IUPAC Name | 5-nitro-1,3-diazinane-2,4,6-trione;hydrate |
| Molecular Weight | 173.08 (anhydrous basis) |
| Molecular Formula | C4H3N3O5 · xH2O |
| Canonical SMILES | C1(C(=O)NC(=O)NC1=O)[N+](=O)[O-].O |
| InChI | InChI=1S/C4H3N3O5.H2O/c8-2-1(7(11)12)3(9)6-4(10)5-2;/h1H,(H2,5,6,8,9,10);1H2 |
| InChIKey | YKGZAIJTCJOZNK-UHFFFAOYSA-N |
| Boiling Point | 303.69°C |
| Melting Point | 180.5°C |
| Purity | 95% |
| Density | 1.8±0.1 g/cm3 |
| Solubility | In vitro: 10 mM in DMSO |
| Appearance | Solid powder |
| Storage | Powder: -20°C: 3 years 4°C: 2 years In solvent: -80°C: 6 months -20°C: 1 month |
| Complexity | 259 |
| Exact Mass | 173.007263 |
| Index Of Refraction | 1.581 |
| In Vitro | 5-Nitrobarbituric acid can inhibit vero cell growth. Cell Cytotoxicity Assay Cell Line: Vero cells Concentration: 0.06-5 μM Incubation Time: 2 hours Result: Showed high cytotoxicity to vero cells. |
| PSA | 121.09000 |
| Target | HSV |
| XLogP3-AA | -1.1 |
