TL;DR: Thymidine 5'-(trisodium hydrogen triphosphate) (CAS 27821-54-1) is a chemical compound with molecular formula C10H17N2Na3O14P3+3 and molecular weight 550.95856 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trisodium;[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
Also Known As: thymidine 5'-triphosphate, Thymidine 5'-(trisodium hydrogen triphosphate), Thymidine 5'-(tetrahydrogen triphosphate), trisodium salt, 2,4(1h,3h)-pyrimidinedione, 1-[2-deoxy-5-o-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]pentofuranosyl]-5-methyl-, sodium salt(1:3), 248-679-4
| Molecular Formula | C10H17N2Na3O14P3+3 |
| Molecular Weight | 550.95856 g/mol |
| XLogP | -10.15 |
| Topological Polar Surface Area (TPSA) | 239.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 550.95856 Da |
| Heavy Atoms | 32 |
| Complexity | 853.0 |
| SMILES | CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O.[Na+].[Na+].[Na+] |
| InChIKey | KNVJTOALWGZWAI-UHFFFAOYSA-N |
The XLogP value of -10.15 indicates that Thymidine 5'-(trisodium hydrogen triphosphate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 239.0 Ų indicates high polarity, suggesting Thymidine 5'-(trisodium hydrogen triphosphate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thymidine 5'-(trisodium hydrogen triphosphate) has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Thymidine 5'-(trisodium hydrogen triphosphate) is 27821-54-1.
The molecular formula of Thymidine 5'-(trisodium hydrogen triphosphate) is C10H17N2Na3O14P3+3.
The molecular weight of Thymidine 5'-(trisodium hydrogen triphosphate) is 550.95856 g/mol.
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