3'-acetylamino-2-fluoro-3'-deoxy-adenosine
TL;DR: 3'-acetylamino-2-fluoro-3'-deoxy-adenosine (CAS 56209-73-5) is a chemical compound with molecular formula C12H15FN6O4 and molecular weight 326.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(6-amino-2-fluoropurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]acetamide
Also Known As: 3'-acetylamino-2-fluoro-3'-deoxy-adenosine, N-[5-(6-AMINO-2-FLUORO-PURIN-9-YL)-4-HYDROXY-2-(HYDROXYMETHYL)OXOLAN-3-YL]ACETAMIDE, 9-(3-Acetamido-3-deoxypentofuranosyl)-2-fluoro-9H-purin-6-amine, N-[5-(6-amino-2-fluoropurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]acetamide
| Molecular Formula | C12H15FN6O4 |
|---|---|
| Molecular Weight | 326.11 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.1139 |
| Heavy Atoms | 23 |
| Complexity | 459.0 |
Chemical Identifiers
| CAS Number | 56209-73-5 |
|---|---|
| SMILES | CC(=O)NC1C(OC(C1O)N2C=NC3=C(N=C(N=C32)F)N)CO |
| InChIKey | PBDVREDGSPITRT-UHFFFAOYSA-N |
Product Overview
3'-acetylamino-2-fluoro-3'-deoxy-adenosine (CAS 56209-73-5), with molecular formula C12H15FN6O4 and molecular weight 326.11 g/mol. IUPAC: N-[5-(6-amino-2-fluoropurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]acetamide.
Chemical Property Profile of 3'-acetylamino-2-fluoro-3'-deoxy-adenosine
Property Insights of 3'-acetylamino-2-fluoro-3'-deoxy-adenosine
The XLogP value of -0.6 indicates that 3'-acetylamino-2-fluoro-3'-deoxy-adenosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 148.0 Ų indicates high polarity, suggesting 3'-acetylamino-2-fluoro-3'-deoxy-adenosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3'-acetylamino-2-fluoro-3'-deoxy-adenosine has 4 hydrogen bond donor(s) and 9 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 3'-acetylamino-2-fluoro-3'-deoxy-adenosine?
The CAS number of 3'-acetylamino-2-fluoro-3'-deoxy-adenosine is 56209-73-5.
What is the molecular formula of 3'-acetylamino-2-fluoro-3'-deoxy-adenosine?
The molecular formula of 3'-acetylamino-2-fluoro-3'-deoxy-adenosine is C12H15FN6O4.
What is the molecular weight of 3'-acetylamino-2-fluoro-3'-deoxy-adenosine?
The molecular weight of 3'-acetylamino-2-fluoro-3'-deoxy-adenosine is 326.11 g/mol.
Where can I buy 3'-acetylamino-2-fluoro-3'-deoxy-adenosine?
You can request a quote for 3'-acetylamino-2-fluoro-3'-deoxy-adenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-acetylamino-2-fluoro-3'-deoxy-adenosine?
Yes, KEHONG BIO provides custom synthesis services for 3'-acetylamino-2-fluoro-3'-deoxy-adenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.