TL;DR: 3'-Deoxy-3'-(fluoromethyl)-5-methyluridine (CAS 146035-73-6) is a chemical compound with molecular formula C11H15FN2O5 and molecular weight 274.0965 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,3R,4S,5S)-4-(fluoromethyl)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Also Known As: 3'-deoxy-3'-(fluoromethyl)-5-methyluridine, 1-[3-(Fluoromethyl)-3-deoxy-beta-D-erythro-pentofuranosyl]thymine, 1-[3-Deoxy-3-C-(fluoromethyl)-3-deoxy-.beta.-D-erythro-pentofuranosyl]thymine, 1-[(2R,3R,4S,5S)-4-(fluoromethyl)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione, 1-[(2R,3R,4S,5S)-4-(fluoromethyl)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
| Molecular Formula | C11H15FN2O5 |
| Molecular Weight | 274.0965 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.0965 Da |
| Heavy Atoms | 19 |
| Complexity | 427.0 |
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)CF)O |
| InChIKey | ZHALTLRSOULQAM-FDDDBJFASA-N |
The XLogP value of -1.2 indicates that 3'-Deoxy-3'-(fluoromethyl)-5-methyluridine 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 3'-Deoxy-3'-(fluoromethyl)-5-methyluridine. Following Lipinski's Rule of Five, 3'-Deoxy-3'-(fluoromethyl)-5-methyluridine 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 3'-Deoxy-3'-(fluoromethyl)-5-methyluridine is 146035-73-6.
The molecular formula of 3'-Deoxy-3'-(fluoromethyl)-5-methyluridine is C11H15FN2O5.
The molecular weight of 3'-Deoxy-3'-(fluoromethyl)-5-methyluridine is 274.0965 g/mol.
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