TL;DR: Etoposide phosphate disodium salt (CAS 122405-33-8) is a chemical compound with molecular formula C29H31Na2O16P and molecular weight 712.1145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;[4-[(5S,5aR,8aR,9R)-5-[[(2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]-2,6-dimethoxyphenyl] phosphate
Also Known As: Etopophos, Etoposide phosphate disodium, Etoposide phosphate disodium salt, BMY-40481-30, 124691-EP2270008A1
| Molecular Formula | C29H31Na2O16P |
| Molecular Weight | 712.1145 g/mol |
| XLogP | -6.1515 |
| Topological Polar Surface Area (TPSA) | 213.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 6 |
| Exact Mass | 712.1145 Da |
| Heavy Atoms | 48 |
| Complexity | 1130.0 |
| SMILES | C[C@@H]1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@@H](O2)O[C@H]3[C@H]4COC(=O)[C@@H]4[C@@H](C5=CC6=C(C=C35)OCO6)C7=CC(=C(C(=C7)OC)OP(=O)([O-])[O-])OC)O)O.[Na+].[Na+] |
| InChIKey | WCOHVOKFXMNYJU-XIYZZTPRSA-L |
The XLogP value of -6.1515 indicates that Etoposide phosphate disodium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 213.0 Ų indicates high polarity, suggesting Etoposide phosphate disodium salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Etoposide phosphate disodium salt has 2 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Etoposide phosphate disodium salt is 122405-33-8.
The molecular formula of Etoposide phosphate disodium salt is C29H31Na2O16P.
The molecular weight of Etoposide phosphate disodium salt is 712.1145 g/mol.
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