TL;DR: Thymidine, 3'-deoxy-3'-fluoro-4-thio- (CAS 124903-20-4) is a chemical compound with molecular formula C10H13FN2O3S and molecular weight 260.06308 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,4S,5R)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-4-sulfanylidenepyrimidin-2-one
Also Known As: 3'-F-4-Thio-ddT, 4-SFLT, Thymidine, 3'-deoxy-3'-fluoro-4-thio-, 2',3'-Dideoxy-3'-fluoro-4-thiothymidine, 1-(2,3-Dideoxy-3-fluoro-beta-D-erythro-pentofuranosyl)-5-methyl-4-sulfanylidene-3,4-dihydropyrimidin-2(1H)-one
| Molecular Formula | C10H13FN2O3S |
| Molecular Weight | 260.06308 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 93.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.06308 Da |
| Heavy Atoms | 17 |
| Complexity | 388.0 |
| SMILES | CC1=CN(C(=O)NC1=S)[C@H]2C[C@@H]([C@H](O2)CO)F |
| InChIKey | RHBTTWULFWNOBZ-XLPZGREQSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thymidine, 3'-deoxy-3'-fluoro-4-thio-. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Thymidine, 3'-deoxy-3'-fluoro-4-thio-. Following Lipinski's Rule of Five, Thymidine, 3'-deoxy-3'-fluoro-4-thio- 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, 3'-deoxy-3'-fluoro-4-thio- is 124903-20-4.
The molecular formula of Thymidine, 3'-deoxy-3'-fluoro-4-thio- is C10H13FN2O3S.
The molecular weight of Thymidine, 3'-deoxy-3'-fluoro-4-thio- is 260.06308 g/mol.
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