TL;DR: 6'-a-F-carbocyclicddU (CAS 129829-87-4) is a chemical compound with molecular formula C10H13FN2O3 and molecular weight 228.09102 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(1S,2S,3S)-2-fluoro-3-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione
Also Known As: 6'-a-F-carbocyclicddU, 6'-a-F-carbocyclic ddU, 2',3'-Dideoxy-6'-alpha-fluoro-carbocyclicuridine, 2',3'-Dideoxy-6'-.alpha.-fluoro-carbocyclicuridine, 1-[(1S,2S,3S)-2-fluoro-3-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione
| Molecular Formula | C10H13FN2O3 |
| Molecular Weight | 228.09102 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.09102 Da |
| Heavy Atoms | 16 |
| Complexity | 345.0 |
| SMILES | C1C[C@@H]([C@H]([C@@H]1CO)F)N2C=CC(=O)NC2=O |
| InChIKey | BGMJYSAHUYZLAO-ZKWXMUAHSA-N |
The XLogP value of -0.3 indicates that 6'-a-F-carbocyclicddU is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6'-a-F-carbocyclicddU. Following Lipinski's Rule of Five, 6'-a-F-carbocyclicddU has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6'-a-F-carbocyclicddU is 129829-87-4.
The molecular formula of 6'-a-F-carbocyclicddU is C10H13FN2O3.
The molecular weight of 6'-a-F-carbocyclicddU is 228.09102 g/mol.
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