TL;DR: 5-Methoxymethyl-1-(2'-deoxylyxofuranosyl)uracil (CAS 104639-39-6) is a chemical compound with molecular formula C11H16N2O6 and molecular weight 272.10083 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2S,4R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(methoxymethyl)pyrimidine-2,4-dione
Also Known As: MMdLU, MMUdR, 5-Methoxymethyl-desoxy-uridin, 5-Methoxymethyl-1-(2'-deoxylyxofuranosyl)uracil, 5-Methoxymethyl-1-(2/'-deoxylyxofuranosyl)uracil
| Molecular Formula | C11H16N2O6 |
| Molecular Weight | 272.10083 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.10083 Da |
| Heavy Atoms | 19 |
| Complexity | 410.0 |
| SMILES | COCC1=CN(C(=O)NC1=O)[C@@H]2C[C@H]([C@H](O2)CO)O |
| InChIKey | RSMISTTWWXJOOG-HLTSFMKQSA-N |
The XLogP value of -1.9 indicates that 5-Methoxymethyl-1-(2'-deoxylyxofuranosyl)uracil is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methoxymethyl-1-(2'-deoxylyxofuranosyl)uracil. Following Lipinski's Rule of Five, 5-Methoxymethyl-1-(2'-deoxylyxofuranosyl)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-Methoxymethyl-1-(2'-deoxylyxofuranosyl)uracil is 104639-39-6.
The molecular formula of 5-Methoxymethyl-1-(2'-deoxylyxofuranosyl)uracil is C11H16N2O6.
The molecular weight of 5-Methoxymethyl-1-(2'-deoxylyxofuranosyl)uracil is 272.10083 g/mol.
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