5-((Cyanomethylene)oxy)-2'-deoxyuridine
TL;DR: 5-((Cyanomethylene)oxy)-2'-deoxyuridine (CAS 77355-97-6) is a chemical compound with molecular formula C11H13N3O6 and molecular weight 283.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]oxyacetonitrile
Also Known As: 5-Cmodu, 5-((Cyanomethylene)oxy)-2'-deoxyuridine, 5-(Cyanomethoxy)-2'-deoxyuridine, Uridine, 5-(cyanomethoxy)-2'-deoxy-, 2'-Deoxy-5-((cyanomethylene)oxy)uridine
| Molecular Formula | C11H13N3O6 |
|---|---|
| Molecular Weight | 283.08 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.08044 |
| Heavy Atoms | 20 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 77355-97-6 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)OCC#N)CO)O |
| InChIKey | CIZYOMOBTNYPRA-NBEYISGCSA-N |
Product Overview
5-((Cyanomethylene)oxy)-2'-deoxyuridine (CAS 77355-97-6), with molecular formula C11H13N3O6 and molecular weight 283.08 g/mol. IUPAC: 2-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]oxyacetonitrile.
Chemical Property Profile of 5-((Cyanomethylene)oxy)-2'-deoxyuridine
Property Insights of 5-((Cyanomethylene)oxy)-2'-deoxyuridine
The XLogP value of -1.6 indicates that 5-((Cyanomethylene)oxy)-2'-deoxyuridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-((Cyanomethylene)oxy)-2'-deoxyuridine. Following Lipinski's Rule of Five, 5-((Cyanomethylene)oxy)-2'-deoxyuridine 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 5-((Cyanomethylene)oxy)-2'-deoxyuridine?
The CAS number of 5-((Cyanomethylene)oxy)-2'-deoxyuridine is 77355-97-6.
What is the molecular formula of 5-((Cyanomethylene)oxy)-2'-deoxyuridine?
The molecular formula of 5-((Cyanomethylene)oxy)-2'-deoxyuridine is C11H13N3O6.
What is the molecular weight of 5-((Cyanomethylene)oxy)-2'-deoxyuridine?
The molecular weight of 5-((Cyanomethylene)oxy)-2'-deoxyuridine is 283.08 g/mol.
Where can I buy 5-((Cyanomethylene)oxy)-2'-deoxyuridine?
You can request a quote for 5-((Cyanomethylene)oxy)-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-((Cyanomethylene)oxy)-2'-deoxyuridine?
Yes, KEHONG BIO provides custom synthesis services for 5-((Cyanomethylene)oxy)-2'-deoxyuridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.