TL;DR: Thymidine, 2',3'-didehydro-3'-deoxy-3'-fluoro- (CAS 121354-03-8) is a chemical compound with molecular formula C10H11FN2O4 and molecular weight 242.07028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,5R)-4-fluoro-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methylpyrimidine-2,4-dione
Also Known As: 3'-FD4T, Thymidine, 2',3'-didehydro-3'-deoxy-3'-fluoro-, 1-(3-Fluoro-2,3-dideoxy-B-D-glycero-pent-2-enofuranosyl)thymine, Thymidine, 2',3'-didehydro-3'-deoxy-3'-fluoro- (9CI), 1-[(2R,5R)-4-fluoro-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
| Molecular Formula | C10H11FN2O4 |
| Molecular Weight | 242.07028 g/mol |
| XLogP | -1.0 |
| Topological Polar Surface Area (TPSA) | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.07028 Da |
| Heavy Atoms | 17 |
| Complexity | 432.0 |
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C=C([C@H](O2)CO)F |
| InChIKey | HOHBSAVNJFQWMJ-HTQZYQBOSA-N |
The XLogP value of -1.0 indicates that Thymidine, 2',3'-didehydro-3'-deoxy-3'-fluoro- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Thymidine, 2',3'-didehydro-3'-deoxy-3'-fluoro-. Following Lipinski's Rule of Five, Thymidine, 2',3'-didehydro-3'-deoxy-3'-fluoro- has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Thymidine, 2',3'-didehydro-3'-deoxy-3'-fluoro- is 121354-03-8.
The molecular formula of Thymidine, 2',3'-didehydro-3'-deoxy-3'-fluoro- is C10H11FN2O4.
The molecular weight of Thymidine, 2',3'-didehydro-3'-deoxy-3'-fluoro- is 242.07028 g/mol.
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