NSC319623
6-benzylsulfanyl-2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazine-3,5-dione
Also Known As: 6-benzylsulfanyl-2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazine-3,5-dione|6-(Benzylsulfanyl)-2-pentofuranosyl-1,2,4-triazine-3,5(2H,4H)-dione
CAS: 90302-11-7
| Molecular Formula | C15H17N3O6S |
|---|---|
| Molecular Weight | 367.0838 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 157.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.0838 |
| Monoisotopic Mass | 367.0838 |
| Heavy Atoms | 25 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 90302-11-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NN(C(=O)NC2=O)C3C(C(C(O3)CO)O)O |
| InChIKey | IKEYLHWZCCHPGE-UHFFFAOYSA-N |
Product Overview
NSC319623 (CAS 90302-11-7), with molecular formula C15H17N3O6S and molecular weight 367.0838 g/mol. IUPAC: 6-benzylsulfanyl-2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazine-3,5-dione.
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.
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