TL;DR: 2-Fluoro-2',3'-dideoxyadenosine (CAS 114849-59-1) is a chemical compound with molecular formula C10H12FN5O2 and molecular weight 253.0975 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2S,5R)-5-(6-amino-2-fluoropurin-9-yl)oxolan-2-yl]methanol
Also Known As: 2-Fdda, 2-Fluoro-2',3'-dideoxyadenosine, 2-F-ddA, Adenosine, 2',3'-dideoxy-2-fluoro-, 2',3'-Dideoxy-2-fluoro-Adenosine
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H12FN5O2 |
| Molecular Weight | 253.0975 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.0975 Da |
| Heavy Atoms | 18 |
| Complexity | 310.0 |
| SMILES | C1C[C@@H](O[C@@H]1CO)N2C=NC3=C(N=C(N=C32)F)N |
| InChIKey | OGSWGOOQBBYAIG-NTSWFWBYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluoro-2',3'-dideoxyadenosine. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Fluoro-2',3'-dideoxyadenosine. Following Lipinski's Rule of Five, 2-Fluoro-2',3'-dideoxyadenosine has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Fluoro-2',3'-dideoxyadenosine is 114849-59-1.
The molecular formula of 2-Fluoro-2',3'-dideoxyadenosine is C10H12FN5O2.
The molecular weight of 2-Fluoro-2',3'-dideoxyadenosine is 253.0975 g/mol.
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