9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine
TL;DR: 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine (CAS 147048-53-1) is a chemical compound with molecular formula C10H11F2N5O3 and molecular weight 287.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4R,5R)-5-(6-amino-2-fluoropurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol
Also Known As: 2'-Deoxy-2'-fluoro-2-fluoroadenosine, 2-Fluoro-2'-fluoro-2'-deoxyadenosine, 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine, Adenosine, 2'-deoxy-2,2'-difluoro-, N0001-004045
| Molecular Formula | C10H11F2N5O3 |
|---|---|
| Molecular Weight | 287.08 g/mol |
| LogP | -0.8637 |
| Topological Polar Surface Area | 119.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.083 |
| Heavy Atoms | 20 |
| Complexity | 651.0999 |
Chemical Identifiers
| CAS Number | 147048-53-1 |
|---|---|
| SMILES | C1=NC2=C(N=C(N=C2N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)F)F)N |
Product Overview
9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine (CAS 147048-53-1), with molecular formula C10H11F2N5O3 and molecular weight 287.08 g/mol. IUPAC: (2R,3R,4R,5R)-5-(6-amino-2-fluoropurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol.
Chemical Property Profile of 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine
Property Insights of 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine
The XLogP value of -0.8637 indicates that 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine. Following Lipinski's Rule of Five, 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine has 3 hydrogen bond donor(s) and 7 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 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine?
The CAS number of 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine is 147048-53-1.
What is the molecular formula of 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine?
The molecular formula of 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine is C10H11F2N5O3.
What is the molecular weight of 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine?
The molecular weight of 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine is 287.08 g/mol.
Where can I buy 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine?
You can request a quote for 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine?
Yes, KEHONG BIO provides custom synthesis services for 9-(2'-Deoxy-2'-fluoro-b-D-ribofuranosyl)-2-fluoroadenine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.