2-Thio-6-azauridine
TL;DR: 2-Thio-6-azauridine (CAS 27089-56-1) is a chemical compound with molecular formula C8H11N3O5S and molecular weight 261.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-sulfanylidene-1,2,4-triazin-5-one
Also Known As: 2-Thio-6-azauridine, 6-Aza-2-thiouridine, 6-Hydroxyflavanone, Triazine dione der., 6-Aza-2-thio-D-uridine
| Molecular Formula | C8H11N3O5S |
|---|---|
| Molecular Weight | 261.04 g/mol |
| LogP | -2.08761 |
| Topological Polar Surface Area | 120.6 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.04193 |
| Heavy Atoms | 17 |
| Complexity | 514.3724 |
Chemical Identifiers
| CAS Number | 27089-56-1 |
|---|---|
| SMILES | C1=NN(C(=S)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O |
Product Overview
2-Thio-6-azauridine (CAS 27089-56-1), with molecular formula C8H11N3O5S and molecular weight 261.04 g/mol. IUPAC: 2-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-sulfanylidene-1,2,4-triazin-5-one.
Chemical Property Profile of 2-Thio-6-azauridine
Property Insights of 2-Thio-6-azauridine
The XLogP value of -2.08761 indicates that 2-Thio-6-azauridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Thio-6-azauridine. Following Lipinski's Rule of Five, 2-Thio-6-azauridine has 4 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 2-Thio-6-azauridine?
The CAS number of 2-Thio-6-azauridine is 27089-56-1.
What is the molecular formula of 2-Thio-6-azauridine?
The molecular formula of 2-Thio-6-azauridine is C8H11N3O5S.
What is the molecular weight of 2-Thio-6-azauridine?
The molecular weight of 2-Thio-6-azauridine is 261.04 g/mol.
Where can I buy 2-Thio-6-azauridine?
You can request a quote for 2-Thio-6-azauridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thio-6-azauridine?
Yes, KEHONG BIO provides custom synthesis services for 2-Thio-6-azauridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.