1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione
TL;DR: 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione (CAS 4803-99-0) is a chemical compound with molecular formula C9H12N2O6 and molecular weight 244.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4,5-trihydroxyoxan-2-yl)pyrimidine-2,4-dione
Also Known As: 1-(3,4,5-trihydroxyoxan-2-yl)pyrimidine-2,4-dione, 1-Pentopyranosylpyrimidine-2,4(1H,3H)-dione, A3003/0126520, 1-(3,5-trihydroxytetrahydro-2H-pyran-2-yl)pyrimidine-2,4(1H,3H)-dione, 5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one
| Molecular Formula | C9H12N2O6 |
|---|---|
| Molecular Weight | 244.07 g/mol |
| LogP | -2.5 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.06953 |
| Heavy Atoms | 17 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 4803-99-0 |
|---|---|
| SMILES | C1C(C(C(C(O1)N2C=CC(=O)NC2=O)O)O)O |
| InChIKey | CYFJUPFBCYRZFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione (CAS 4803-99-0), with molecular formula C9H12N2O6 and molecular weight 244.07 g/mol. IUPAC: 1-(3,4,5-trihydroxyoxan-2-yl)pyrimidine-2,4-dione.
Chemical Property Profile of 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione
Property Insights of 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione
The XLogP value of -2.5 indicates that 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione has 4 hydrogen bond donor(s) and 6 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 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione?
The CAS number of 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione is 4803-99-0.
What is the molecular formula of 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione?
The molecular formula of 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione is C9H12N2O6.
What is the molecular weight of 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione?
The molecular weight of 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione is 244.07 g/mol.
Where can I buy 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione?
You can request a quote for 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4,5-Trihydroxyoxan-2-yl)pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.