TL;DR: 5-Iodo-1-(2-fluoro-2-deoxyribofuranosyl)uracil (CAS 120332-44-7) is a chemical compound with molecular formula C9H10FIN2O5 and molecular weight 371.96185 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione
Also Known As: 2'-Deoxy-2'-fluoro-5-iodouridine, 2'-epi-Fialuridine, 5-Ifdu, FIRU cpd, FIALURIDINE
| Molecular Formula | C9H10FIN2O5 |
| Molecular Weight | 371.96185 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 371.96185 Da |
| Heavy Atoms | 18 |
| Complexity | 418.0 |
| SMILES | C1=C(C(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)F)I |
| InChIKey | IPVFGAYTKQKGBM-UAKXSSHOSA-N |
The XLogP value of -0.9 indicates that 5-Iodo-1-(2-fluoro-2-deoxyribofuranosyl)uracil is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Iodo-1-(2-fluoro-2-deoxyribofuranosyl)uracil. Following Lipinski's Rule of Five, 5-Iodo-1-(2-fluoro-2-deoxyribofuranosyl)uracil has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-Iodo-1-(2-fluoro-2-deoxyribofuranosyl)uracil is 120332-44-7.
The molecular formula of 5-Iodo-1-(2-fluoro-2-deoxyribofuranosyl)uracil is C9H10FIN2O5.
The molecular weight of 5-Iodo-1-(2-fluoro-2-deoxyribofuranosyl)uracil is 371.96185 g/mol.
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