1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine
TL;DR: 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine (CAS 105281-06-9) is a chemical compound with molecular formula C10H13FN2O4 and molecular weight 244.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-methyloxolan-2-yl]-5-methylpyrimidine-2,4-dione
Also Known As: 5'-deoxy-FMAU, 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine, 1-(2,5-Dideoxy-2-fluoro-.beta.-D-arabinofuranosyl)thymine, 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione, 1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-methyloxolan-2-yl]-5-methylpyrimidine-2,4-dione
| Molecular Formula | C10H13FN2O4 |
|---|---|
| Molecular Weight | 244.09 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.08594 |
| Heavy Atoms | 17 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 105281-06-9 |
|---|---|
| SMILES | C[C@@H]1[C@H]([C@@H]([C@@H](O1)N2C=C(C(=O)NC2=O)C)F)O |
| InChIKey | MSKVIXDVIHZATN-JVZYCSMKSA-N |
Product Overview
1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine (CAS 105281-06-9), with molecular formula C10H13FN2O4 and molecular weight 244.09 g/mol. IUPAC: 1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-methyloxolan-2-yl]-5-methylpyrimidine-2,4-dione.
Chemical Property Profile of 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine
Property Insights of 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine
The XLogP value of -0.4 indicates that 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine. Following Lipinski's Rule of Five, 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine?
The CAS number of 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine is 105281-06-9.
What is the molecular formula of 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine?
The molecular formula of 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine is C10H13FN2O4.
What is the molecular weight of 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine?
The molecular weight of 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine is 244.09 g/mol.
Where can I buy 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine?
You can request a quote for 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,5-Dideoxy-2-fluoro-beta-D-arabinofuranosyl)thymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.