TL;DR: diSilyl-3'CN-3'MeSylT TSAO deriv. (CAS 141684-44-8) is a chemical compound with molecular formula C24H43N3O8SSi2 and molecular weight 589.23096 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3R,4R,5R)-4-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-cyano-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] methanesulfonate
Also Known As: diSilyl-3'CN-3'MeSylT TSAO deriv., 1-(2',5'-Bis-O-(tert-butyldimethylsilyl)-3'-C-cyano-3'-O-mesyl-beta-D-ribofuranosyl)thymine, 2',5'-Bis-O-[tert-butyldi(methyl)silyl]-3'-C-cyano-3'-O-(methanesulfonyl)-5-methyluridine, [(2R,3R,4R,5R)-4-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-cyano-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl] methanesulfonate, [(2R,3R,4R,5R)-4-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-cyano-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] methanesulfonate
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C24H43N3O8SSi2 |
| Molecular Weight | 589.23096 g/mol |
| XLogP | 3.3932 |
| Topological Polar Surface Area (TPSA) | 153.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 589.23096 Da |
| Heavy Atoms | 38 |
| Complexity | 1140.0 |
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@]([C@H](O2)CO[Si](C)(C)C(C)(C)C)(C#N)OS(=O)(=O)C)O[Si](C)(C)C(C)(C)C |
| InChIKey | NSVJFTGUTFJYAS-DSPLJNTKSA-N |
The XLogP value of 3.3932 indicates that diSilyl-3'CN-3'MeSylT TSAO deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.0 Ų indicates high polarity, suggesting diSilyl-3'CN-3'MeSylT TSAO deriv. may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, diSilyl-3'CN-3'MeSylT TSAO deriv. has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of diSilyl-3'CN-3'MeSylT TSAO deriv. is 141684-44-8.
The molecular formula of diSilyl-3'CN-3'MeSylT TSAO deriv. is C24H43N3O8SSi2.
The molecular weight of diSilyl-3'CN-3'MeSylT TSAO deriv. is 589.23096 g/mol.
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