TL;DR: Uridine 5'-diphosphate chloroacetol (CAS 125303-04-0) is a chemical compound with molecular formula C12H17ClN2O13P2 and molecular weight 493.98944 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3S,4R,5R)-2-[(3-chloro-2-oxopropoxy)methyl]-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl] phosphono hydrogen phosphate
Also Known As: Udp chloroacetol, Uridine 5'-diphosphate chloroacetol, Uridine 5/'-diphosphate chloroacetol, [(2R,3S,4R,5R)-2-[(3-chloro-2-oxopropoxy)methyl]-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl] phosphono hydrogen phosphate, Uridine 5'-(trihydrogen diphosphate), P'-(3-chloro-2-oxopropyl) ester
| Molecular Formula | C12H17ClN2O13P2 |
| Molecular Weight | 493.98944 g/mol |
| XLogP | -4.1 |
| Topological Polar Surface Area (TPSA) | 218.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 10 |
| Exact Mass | 493.98944 Da |
| Heavy Atoms | 30 |
| Complexity | 816.0 |
| SMILES | C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COCC(=O)CCl)OP(=O)(O)OP(=O)(O)O)O |
| InChIKey | SUOHVUDMBFAFKZ-QCNRFFRDSA-N |
The XLogP value of -4.1 indicates that Uridine 5'-diphosphate chloroacetol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 218.0 Ų indicates high polarity, suggesting Uridine 5'-diphosphate chloroacetol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Uridine 5'-diphosphate chloroacetol has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Uridine 5'-diphosphate chloroacetol is 125303-04-0.
The molecular formula of Uridine 5'-diphosphate chloroacetol is C12H17ClN2O13P2.
The molecular weight of Uridine 5'-diphosphate chloroacetol is 493.98944 g/mol.
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