TL;DR: Diphosphoglucose-AzddU (CAS 132278-28-5) is a chemical compound with molecular formula C15H23N5O15P2 and molecular weight 575.0666 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[[(2S,3S,5R)-3-azido-5-(2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
Also Known As: Diphosphoglucose-AzddU, 5'-Diphosphoglucose-3'-azido-2',3'-dideoxyuridine, Uridine 5'-(trihydrogen diphosphate), 3'-azido-2',3'-dideoxy-, P'-alpha-D-glucopyranosyl ester, [(2S,3S,5R)-3-Azido-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)oxolan-2-yl]methyl (2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl dihydrogen diphosphate, [[(2S,3S,5R)-3-azido-5-(2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
| Molecular Formula | C15H23N5O15P2 |
| Molecular Weight | 575.0666 g/mol |
| XLogP | -4.1 |
| Topological Polar Surface Area (TPSA) | 265.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 10 |
| Exact Mass | 575.0666 Da |
| Heavy Atoms | 37 |
| Complexity | 1050.0 |
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=CC(=O)NC2=O)COP(=O)(O)OP(=O)(O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)N=[N+]=[N-] |
| InChIKey | UMRLAMTYOVYVEO-SEKGBAOZSA-N |
The XLogP value of -4.1 indicates that Diphosphoglucose-AzddU is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 265.0 Ų indicates high polarity, suggesting Diphosphoglucose-AzddU may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Diphosphoglucose-AzddU has 7 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Diphosphoglucose-AzddU is 132278-28-5.
The molecular formula of Diphosphoglucose-AzddU is C15H23N5O15P2.
The molecular weight of Diphosphoglucose-AzddU is 575.0666 g/mol.
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