9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine
TL;DR: 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine (CAS 150863-85-7) is a chemical compound with molecular formula C11H12FIN4O4 and molecular weight 409.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-5-(2-iodo-6-methoxypurin-9-yl)oxolan-3-ol
Also Known As: 9-Dfr-2-I-6-MP, 2I-2'F6MeO-Pur, 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine, (2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-5-(2-iodo-6-methoxypurin-9-yl)oxolan-3-ol, 2-Iodo-6-methoxy-9-(2-deoxy-2-fluoro-.beta.-D-ribofuranosyl)purine
| Molecular Formula | C11H12FIN4O4 |
|---|---|
| Molecular Weight | 409.99 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.98874 |
| Heavy Atoms | 21 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 150863-85-7 |
|---|---|
| SMILES | COC1=NC(=NC2=C1N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)F)I |
| InChIKey | RZNPNDVANHIBAN-QYYRPYCUSA-N |
Product Overview
9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine (CAS 150863-85-7), with molecular formula C11H12FIN4O4 and molecular weight 409.99 g/mol. IUPAC: (2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-5-(2-iodo-6-methoxypurin-9-yl)oxolan-3-ol.
Chemical Property Profile of 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine
Property Insights of 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine. Following Lipinski's Rule of Five, 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine has 2 hydrogen bond donor(s) and 8 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-fluororibofuranosyl)-2-iodo-6-methoxypurine?
The CAS number of 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine is 150863-85-7.
What is the molecular formula of 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine?
The molecular formula of 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine is C11H12FIN4O4.
What is the molecular weight of 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine?
The molecular weight of 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine is 409.99 g/mol.
Where can I buy 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine?
You can request a quote for 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine 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-fluororibofuranosyl)-2-iodo-6-methoxypurine?
Yes, KEHONG BIO provides custom synthesis services for 9-(2-Deoxy-2-fluororibofuranosyl)-2-iodo-6-methoxypurine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.