[5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate
TL;DR: [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate (CAS 15147-68-9) is a chemical compound with molecular formula C9H13N3O8S and molecular weight 323.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate
Also Known As: [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate|2-[5-O-(Methanesulfonyl)pentofuranosyl]-1,2,4-triazine-3,5(2H,4H)-dione
| Molecular Formula | C9H13N3O8S |
|---|---|
| Molecular Weight | 323.04 g/mol |
| LogP | -2.6 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.04233 |
| Heavy Atoms | 21 |
| Complexity | 570.0 |
Chemical Identifiers
| CAS Number | 15147-68-9 |
|---|---|
| SMILES | CS(=O)(=O)OCC1C(C(C(O1)N2C(=O)NC(=O)C=N2)O)O |
| InChIKey | QEQFJLUSKCCIHL-UHFFFAOYSA-N |
Product Overview
[5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate (CAS 15147-68-9), with molecular formula C9H13N3O8S and molecular weight 323.04 g/mol. IUPAC: [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate.
Chemical Property Profile of [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate
Property Insights of [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate
The XLogP value of -2.6 indicates that [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 163.0 Ų indicates high polarity, suggesting [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate has 3 hydrogen bond donor(s) and 9 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-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate?
The CAS number of [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate is 15147-68-9.
What is the molecular formula of [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate?
The molecular formula of [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate is C9H13N3O8S.
What is the molecular weight of [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate?
The molecular weight of [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate is 323.04 g/mol.
Where can I buy [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate?
You can request a quote for [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxyoxolan-2-yl]methyl methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.