AC1LA97J
5-cyclopropyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]pyrimidine-2,4-dione
Also Known As: 5-Cyclopropyl-2'-deoxy-4'-thiouridine|uridine, 5-cyclopropyl-2'-deoxy-4'-thio-|1-(2-Deoxy-4-thio-beta-D-erythro-pentofuranosyl)-5-cyclopropyluracil|1-[4alpha-Hydroxy-5beta-(hydroxymethyl)tetrahydrothiophene-2beta-yl]-5-cyclopropyluracil|5-cyclopropyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]pyrimidine-2,4-dione|5-cyclopropyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrothiophen-2-yl]pyrimidine-2,4-dione|5-cyclopropyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
| Molecular Formula | C12H16N2O4S |
|---|---|
| Molecular Weight | 284.08307 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.08307 |
| Monoisotopic Mass | 284.08307 |
| Heavy Atoms | 19 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 174357-90-5 |
|---|---|
| SMILES | C1CC1C2=CN(C(=O)NC2=O)[C@H]3C[C@@H]([C@H](S3)CO)O |
| InChIKey | HTWHBUHWCYXDGV-IVZWLZJFSA-N |
Product Overview
AC1LA97J (CAS 174357-90-5), with molecular formula C12H16N2O4S and molecular weight 284.08307 g/mol. IUPAC: 5-cyclopropyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]pyrimidine-2,4-dione.