5,5-Dibromobarbituric acid
TL;DR: 5,5-Dibromobarbituric acid (CAS 511-67-1) is a chemical compound with molecular formula C4H2Br2N2O3 and molecular weight 283.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dibromo-1,3-diazinane-2,4,6-trione
Also Known As: 5,5-Dibromobarbituric acid, Dibromin, null, Dibromine, Dibrombarbitursaure
| Molecular Formula | C4H2Br2N2O3 |
|---|---|
| Molecular Weight | 283.84 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 285.84116 |
| Heavy Atoms | 11 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 511-67-1 |
|---|---|
| SMILES | C1(=O)C(C(=O)NC(=O)N1)(Br)Br |
| InChIKey | AMATXUCYHHHHHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,5-Dibromobarbituric acid (CAS 511-67-1), with molecular formula C4H2Br2N2O3 and molecular weight 283.84 g/mol. IUPAC: 5,5-dibromo-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5,5-Dibromobarbituric acid
Property Insights of 5,5-Dibromobarbituric acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-Dibromobarbituric acid. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5-Dibromobarbituric acid. Following Lipinski's Rule of Five, 5,5-Dibromobarbituric 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 5,5-Dibromobarbituric acid?
The CAS number of 5,5-Dibromobarbituric acid is 511-67-1.
What is the molecular formula of 5,5-Dibromobarbituric acid?
The molecular formula of 5,5-Dibromobarbituric acid is C4H2Br2N2O3.
What is the molecular weight of 5,5-Dibromobarbituric acid?
The molecular weight of 5,5-Dibromobarbituric acid is 283.84 g/mol.
Where can I buy 5,5-Dibromobarbituric acid?
You can request a quote for 5,5-Dibromobarbituric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Dibromobarbituric acid?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Dibromobarbituric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.