3'-O-acetyl-2'-deoxy-5-methoxymethyluridine
TL;DR: 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine (CAS 113203-27-3) is a chemical compound with molecular formula C13H18N2O7 and molecular weight 314.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-(methylperoxymethyl)oxolan-3-yl] acetate
Also Known As: Mmacdurd, Thymidine, alpha-methoxy-, 3'-acetate, 3'-O-Acetyl-2'-deoxy-5-methoxymethyluridine, 3/'-O-acetyl-2/'-deoxy-5-methoxymethyluridine, [(2R,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-(methylperoxymethyl)oxolan-3-yl] acetate
| Molecular Formula | C13H18N2O7 |
|---|---|
| Molecular Weight | 314.11 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.1114 |
| Heavy Atoms | 22 |
| Complexity | 505.0 |
Chemical Identifiers
| CAS Number | 113203-27-3 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COOC)OC(=O)C |
| InChIKey | GEPZYEHBJZJNEL-HBNTYKKESA-N |
Product Overview
3'-O-acetyl-2'-deoxy-5-methoxymethyluridine (CAS 113203-27-3), with molecular formula C13H18N2O7 and molecular weight 314.11 g/mol. IUPAC: [(2R,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-(methylperoxymethyl)oxolan-3-yl] acetate.
Chemical Property Profile of 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine
Property Insights of 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine
The XLogP value of -0.2 indicates that 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine. Following Lipinski's Rule of Five, 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine has 1 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 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine?
The CAS number of 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine is 113203-27-3.
What is the molecular formula of 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine?
The molecular formula of 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine is C13H18N2O7.
What is the molecular weight of 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine?
The molecular weight of 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine is 314.11 g/mol.
Where can I buy 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine?
You can request a quote for 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine?
Yes, KEHONG BIO provides custom synthesis services for 3'-O-acetyl-2'-deoxy-5-methoxymethyluridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.