5-(123I)Iodo-2'-deoxyuridine
TL;DR: 5-(123I)Iodo-2'-deoxyuridine (CAS 53745-34-9) is a chemical compound with molecular formula C9H11IN2O5 and molecular weight 349.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(123I)iodopyrimidine-2,4-dione
Also Known As: idoxuridine, 123I-IUdR, IDOXURIDINE I-123, 5-(123I)Iodo-2'-deoxyuridine, Iododeoxyuridine 123ILabeled
| Molecular Formula | C9H11IN2O5 |
|---|---|
| Molecular Weight | 349.97 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.97238 |
| Heavy Atoms | 17 |
| Complexity | 386.0 |
Chemical Identifiers
| CAS Number | 53745-34-9 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)[123I])CO)O |
| InChIKey | XQFRJNBWHJMXHO-FANCZFNKSA-N |
Product Overview
5-(123I)Iodo-2'-deoxyuridine (CAS 53745-34-9), with molecular formula C9H11IN2O5 and molecular weight 349.97 g/mol. IUPAC: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(123I)iodopyrimidine-2,4-dione.
Chemical Property Profile of 5-(123I)Iodo-2'-deoxyuridine
Property Insights of 5-(123I)Iodo-2'-deoxyuridine
The XLogP value of -1.0 indicates that 5-(123I)Iodo-2'-deoxyuridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(123I)Iodo-2'-deoxyuridine. Following Lipinski's Rule of Five, 5-(123I)Iodo-2'-deoxyuridine has 3 hydrogen bond donor(s) and 5 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-(123I)Iodo-2'-deoxyuridine?
The CAS number of 5-(123I)Iodo-2'-deoxyuridine is 53745-34-9.
What is the molecular formula of 5-(123I)Iodo-2'-deoxyuridine?
The molecular formula of 5-(123I)Iodo-2'-deoxyuridine is C9H11IN2O5.
What is the molecular weight of 5-(123I)Iodo-2'-deoxyuridine?
The molecular weight of 5-(123I)Iodo-2'-deoxyuridine is 349.97 g/mol.
Where can I buy 5-(123I)Iodo-2'-deoxyuridine?
You can request a quote for 5-(123I)Iodo-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-(123I)Iodo-2'-deoxyuridine?
Yes, KEHONG BIO provides custom synthesis services for 5-(123I)Iodo-2'-deoxyuridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.