[3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate
TL;DR: [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate (CAS 3257-80-5) is a chemical compound with molecular formula C10H12N2O7S and molecular weight 304.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate
Also Known As: [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate|1-[2,5-Anhydro-3-O-(methanesulfonyl)pentofuranosyl]pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C10H12N2O7S |
|---|---|
| Molecular Weight | 304.04 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.03653 |
| Heavy Atoms | 20 |
| Complexity | 581.0 |
Chemical Identifiers
| CAS Number | 3257-80-5 |
|---|---|
| SMILES | CS(=O)(=O)OC1C2COC1C(O2)N3C=CC(=O)NC3=O |
| InChIKey | MVTPQCYNBQHPHB-UHFFFAOYSA-N |
Product Overview
[3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate (CAS 3257-80-5), with molecular formula C10H12N2O7S and molecular weight 304.04 g/mol. IUPAC: [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate.
Chemical Property Profile of [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate
Property Insights of [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate
The XLogP value of -1.8 indicates that [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate. Following Lipinski's Rule of Five, [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate 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-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate?
The CAS number of [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate is 3257-80-5.
What is the molecular formula of [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate?
The molecular formula of [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate is C10H12N2O7S.
What is the molecular weight of [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate?
The molecular weight of [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate is 304.04 g/mol.
Where can I buy [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate?
You can request a quote for [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [3-(2,4-dioxopyrimidin-1-yl)-2,5-dioxabicyclo[2.2.1]heptan-7-yl] methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.