AC1L9XJL
[(2S,3S,5R)-3-azido-5-[2-oxo-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]oxolan-2-yl]methyl acetate
Also Known As: Acetic acid 3-azido-5-(2-oxo-4-(1,2,4)triazol-1-yl-2H-pyrimidin-1-yl)-tetrahydro-furan-2-ylmethyl ester furan-2-ylmethyl ester|[(2S,3S,5R)-3-azido-5-[2-oxo-4-(1,2,4-triazol-1-yl)pyrimidin|[(2S,3S,5R)-3-azido-5-[2-oxo-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]oxolan-2-yl]methyl acetate|[(2S,3S,5R)-3-azido-5-[2-oxo-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl acetate|1-(5-O-Acetyl-3-azido-2,3-dideoxy-beta-D-erythro-pentofuranosyl)-4-(1H-1,2,4-triazol-1-yl)pyrimidin-2(1H)-one|Acetic acid 3-azido-5-(2-oxo-4-[1,2,4]triazol-1-yl-2H-pyrimidin-1-yl)-tetrahydro-furan-2-ylmethyl ester furan-2-ylmethyl ester
| Molecular Formula | C13H14N8O4 |
|---|---|
| Molecular Weight | 346.1138 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 346.1138 |
| Monoisotopic Mass | 346.1138 |
| Heavy Atoms | 25 |
| Complexity | 658.0 |
Chemical Identifiers
| CAS Number | 87190-76-9 |
|---|---|
| SMILES | CC(=O)OC[C@@H]1[C@H](C[C@@H](O1)N2C=CC(=NC2=O)N3C=NC=N3)N=[N+]=[N-] |
| InChIKey | SGSTZVCBHMEELE-HOSYDEDBSA-N |
Product Overview
AC1L9XJL (CAS 87190-76-9), with molecular formula C13H14N8O4 and molecular weight 346.1138 g/mol. IUPAC: [(2S,3S,5R)-3-azido-5-[2-oxo-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]oxolan-2-yl]methyl acetate.
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