5-羟基尿嘧啶
TL;DR: 5-羟基尿嘧啶 (CAS 496-76-4) is a chemical compound with molecular formula C4H4N2O3 and molecular weight 128.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-羟基尿嘧啶
1,3-diazinane-2,4,5-trione
Also Known As: Isobarbituric acid, 5-Hydroxyuracil, Dihydropyrimidine-2,4,5(3H)-trione, 2,4,5-Trihydroxypyrimidine, IsobarbituricAcid
| Molecular Formula | C4H4N2O3 |
|---|---|
| Molecular Weight | 128.02 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.02219 |
| Heavy Atoms | 9 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 496-76-4 |
|---|---|
| SMILES | C1C(=O)C(=O)NC(=O)N1 |
| InChIKey | FQXOOGHQVPKHPG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-羟基尿嘧啶 (CAS 496-76-4), with molecular formula C4H4N2O3 and molecular weight 128.02 g/mol. IUPAC: 1,3-diazinane-2,4,5-trione.
Chemical Property Profile of 5-羟基尿嘧啶
Property Insights of 5-羟基尿嘧啶
The XLogP value of -1.2 indicates that 5-羟基尿嘧啶 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-羟基尿嘧啶. Following Lipinski's Rule of Five, 5-羟基尿嘧啶 has 2 hydrogen bond donor(s) and 3 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-羟基尿嘧啶?
The CAS number of 5-羟基尿嘧啶 is 496-76-4.
What is the molecular formula of 5-羟基尿嘧啶?
The molecular formula of 5-羟基尿嘧啶 is C4H4N2O3.
What is the molecular weight of 5-羟基尿嘧啶?
The molecular weight of 5-羟基尿嘧啶 is 128.02 g/mol.
Where can I buy 5-羟基尿嘧啶?
You can request a quote for 5-羟基尿嘧啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-羟基尿嘧啶?
Yes, KEHONG BIO provides custom synthesis services for 5-羟基尿嘧啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.