Parabanic acid
TL;DR: Parabanic acid (CAS 120-89-8) is a chemical compound with molecular formula C3H2N2O3 and molecular weight 114.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
imidazolidine-2,4,5-trione
Also Known As: Parabanic acid, imidazolidine-2,4,5-trione, Oxalylurea, 2,4,5-Imidazolidinetrione, IMIDAZOLIDINETRIONE
| Molecular Formula | C3H2N2O3 |
|---|---|
| Molecular Weight | 114.01 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 114.00654 |
| Heavy Atoms | 8 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 120-89-8 |
|---|---|
| SMILES | C1(=O)C(=O)NC(=O)N1 |
| InChIKey | ZFLIKDUSUDBGCD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Parabanic acid (CAS 120-89-8), with molecular formula C3H2N2O3 and molecular weight 114.01 g/mol. IUPAC: imidazolidine-2,4,5-trione.
Chemical Property Profile of Parabanic acid
Property Insights of Parabanic acid
The XLogP value of -0.9 indicates that Parabanic acid 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 Parabanic acid. Following Lipinski's Rule of Five, Parabanic acid 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 Parabanic acid?
The CAS number of Parabanic acid is 120-89-8.
What is the molecular formula of Parabanic acid?
The molecular formula of Parabanic acid is C3H2N2O3.
What is the molecular weight of Parabanic acid?
The molecular weight of Parabanic acid is 114.01 g/mol.
Where can I buy Parabanic acid?
You can request a quote for Parabanic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Parabanic acid?
Yes, KEHONG BIO provides custom synthesis services for Parabanic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.