5,5-Dibenzyl-barbituric acid
TL;DR: 5,5-Dibenzyl-barbituric acid (CAS 26371-47-1) is a chemical compound with molecular formula C18H16N2O3 and molecular weight 308.1161 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,5-dibenzyl-1,3-diazinane-2,4,6-trione
Also Known As: 5,5-Dibenzylbarbituric acid, Dibenzylbarbitursaure, BARBITURIC ACID, 5,5-DIBENZYL-, 5,5-Dibenzyl-barbituric acid, 5,5-Dibenzylbarbituricacid
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H16N2O3 |
| Molecular Weight | 308.1161 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.1161 Da |
| Heavy Atoms | 23 |
| Complexity | 435.0 |
| SMILES | C1=CC=C(C=C1)CC2(C(=O)NC(=O)NC2=O)CC3=CC=CC=C3 |
| InChIKey | SLCFHAGEVYERLB-UHFFFAOYSA-N |
Chemical Property Profile of 5,5-Dibenzyl-barbituric acid
Property Insights of 5,5-Dibenzyl-barbituric acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-Dibenzyl-barbituric acid. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5-Dibenzyl-barbituric acid. Following Lipinski's Rule of Five, 5,5-Dibenzyl-barbituric 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
What is the CAS number of 5,5-Dibenzyl-barbituric acid?
The CAS number of 5,5-Dibenzyl-barbituric acid is 26371-47-1.
What is the molecular formula of 5,5-Dibenzyl-barbituric acid?
The molecular formula of 5,5-Dibenzyl-barbituric acid is C18H16N2O3.
What is the molecular weight of 5,5-Dibenzyl-barbituric acid?
The molecular weight of 5,5-Dibenzyl-barbituric acid is 308.1161 g/mol.
Where can I buy 5,5-Dibenzyl-barbituric acid?
You can request a quote for 5,5-Dibenzyl-barbituric acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5,5-Dibenzyl-barbituric acid?
Yes, CoreyChem provides custom synthesis services for 5,5-Dibenzyl-barbituric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.