5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine
TL;DR: 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine (CAS 119771-21-0) is a chemical compound with molecular formula C11H14FN5O3S and molecular weight 315.08014 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-[(R)-fluoro(methylsulfanyl)methyl]oxolane-3,4-diol
Also Known As: 5'-Dfma, 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine, (5R)-5'-C-Fluoro-5'-S-methyl-5'-thioadenosine, 5/'-deoxy-5/'-fluoro-5/'-(methylthio)adenosine, Adenosine, 5'-C-fluoro-5'-S-methyl-5'-thio-, (5'R)-
Technical Specifications
| Molecular Formula | C11H14FN5O3S |
| Molecular Weight | 315.08014 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 145.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.08014 Da |
| Heavy Atoms | 21 |
| Complexity | 384.0 |
| SMILES | CS[C@H]([C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O)F |
| InChIKey | BTYPROBTLQKCNI-YUECIMINSA-N |
Chemical Property Profile of 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine
Property Insights of 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine. The TPSA of 145.0 Ų indicates high polarity, suggesting 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine?
The CAS number of 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine is 119771-21-0.
What is the molecular formula of 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine?
The molecular formula of 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine is C11H14FN5O3S.
What is the molecular weight of 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine?
The molecular weight of 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine is 315.08014 g/mol.
Where can I buy 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine?
You can request a quote for 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine?
Yes, CoreyChem provides custom synthesis services for 5'-Deoxy-5'-fluoro-5'-(methylthio)adenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.