5-Fluoro-5'-O-nitro-2'-deoxyuridine
TL;DR: 5-Fluoro-5'-O-nitro-2'-deoxyuridine (CAS 77421-85-3) is a chemical compound with molecular formula C9H10FN3O7 and molecular weight 291.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,5R)-5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl nitrate
Also Known As: FDUMN, 5-Fluoro-5'-O-nitro-2'-deoxyuridine, 2'-Deoxy-5-fluoro-5'-O-nitrouridine, Uridine, 2'-deoxy-5-fluoro-, 5'-nitrate, Uridine,2'-deoxy-5-fluoro-, 5'-nitrate (9CI)
| Molecular Formula | C9H10FN3O7 |
|---|---|
| Molecular Weight | 291.05 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.0503 |
| Heavy Atoms | 20 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 77421-85-3 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)F)CO[N+](=O)[O-])O |
| InChIKey | FUMAOUACDCPWNK-RRKCRQDMSA-N |
Product Overview
5-Fluoro-5'-O-nitro-2'-deoxyuridine (CAS 77421-85-3), with molecular formula C9H10FN3O7 and molecular weight 291.05 g/mol. IUPAC: [(2R,3S,5R)-5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl nitrate.
Chemical Property Profile of 5-Fluoro-5'-O-nitro-2'-deoxyuridine
Property Insights of 5-Fluoro-5'-O-nitro-2'-deoxyuridine
The XLogP value of -0.8 indicates that 5-Fluoro-5'-O-nitro-2'-deoxyuridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Fluoro-5'-O-nitro-2'-deoxyuridine. Following Lipinski's Rule of Five, 5-Fluoro-5'-O-nitro-2'-deoxyuridine 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 5-Fluoro-5'-O-nitro-2'-deoxyuridine?
The CAS number of 5-Fluoro-5'-O-nitro-2'-deoxyuridine is 77421-85-3.
What is the molecular formula of 5-Fluoro-5'-O-nitro-2'-deoxyuridine?
The molecular formula of 5-Fluoro-5'-O-nitro-2'-deoxyuridine is C9H10FN3O7.
What is the molecular weight of 5-Fluoro-5'-O-nitro-2'-deoxyuridine?
The molecular weight of 5-Fluoro-5'-O-nitro-2'-deoxyuridine is 291.05 g/mol.
Where can I buy 5-Fluoro-5'-O-nitro-2'-deoxyuridine?
You can request a quote for 5-Fluoro-5'-O-nitro-2'-deoxyuridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Fluoro-5'-O-nitro-2'-deoxyuridine?
Yes, KEHONG BIO provides custom synthesis services for 5-Fluoro-5'-O-nitro-2'-deoxyuridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.