Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate)
TL;DR: Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate) (CAS 139459-43-1) is a chemical compound with molecular formula C11H16FN2O6P and molecular weight 322.073 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3S,5R)-3-fluoro-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphinic acid
Also Known As: FLT-MeP, Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate), 3'-Deoxy-3'-fluoro-5'-O-[hydroxy(methyl)phosphoryl]thymidine, [(2R,3S,5R)-3-fluoro-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-methyl-phosphinic acid, [(2R,3S,5R)-3-fluoro-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphinic acid
Technical Specifications
| Molecular Formula | C11H16FN2O6P |
| Molecular Weight | 322.073 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.073 Da |
| Heavy Atoms | 21 |
| Complexity | 539.0 |
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(C)O)F |
| InChIKey | ZDXSFTCMMYNLEF-DJLDLDEBSA-N |
Chemical Property Profile of Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate)
Property Insights of Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate)
The XLogP value of -0.9 indicates that Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate). Following Lipinski's Rule of Five, Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate) has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate)?
The CAS number of Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate) is 139459-43-1.
What is the molecular formula of Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate)?
The molecular formula of Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate) is C11H16FN2O6P.
What is the molecular weight of Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate)?
The molecular weight of Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate) is 322.073 g/mol.
Where can I buy Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate)?
You can request a quote for Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate)?
Yes, CoreyChem provides custom synthesis services for Thymidine, 3'-deoxy-3'-fluoro-, 5'-(hydrogen methylphosphonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.