1-Benzyl-5,5-diethylbarbituric acid
TL;DR: 1-Benzyl-5,5-diethylbarbituric acid (CAS 92870-36-5) is a chemical compound with molecular formula C15H18N2O3 and molecular weight 274.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5,5-diethyl-1,3-diazinane-2,4,6-trione
Also Known As: 1-Benzyl-5,5-diethylbarbituric acid, EINECS 296-610-1, 1-benzyl-5,5-diethylbarbituricacid, 1-benzyl-5,5-diethyl-1,3-diazinane-2,4,6-trione, Barbituric acid, 1-benzyl-5,5-diethyl-
| Molecular Formula | C15H18N2O3 |
|---|---|
| Molecular Weight | 274.13 g/mol |
| LogP | 2.0714 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.13174 |
| Heavy Atoms | 20 |
| Complexity | 535.30945 |
Chemical Identifiers
| CAS Number | 92870-36-5 |
|---|---|
| SMILES | CCC1(C(=O)NC(=O)N(C1=O)CC2=CC=CC=C2)CC |
Product Overview
1-Benzyl-5,5-diethylbarbituric acid (CAS 92870-36-5), with molecular formula C15H18N2O3 and molecular weight 274.13 g/mol. IUPAC: 1-benzyl-5,5-diethyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 1-Benzyl-5,5-diethylbarbituric acid
Property Insights of 1-Benzyl-5,5-diethylbarbituric acid
The XLogP value of 2.0714 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-5,5-diethylbarbituric acid. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzyl-5,5-diethylbarbituric acid. Following Lipinski's Rule of Five, 1-Benzyl-5,5-diethylbarbituric acid has 1 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 1-Benzyl-5,5-diethylbarbituric acid?
The CAS number of 1-Benzyl-5,5-diethylbarbituric acid is 92870-36-5.
What is the molecular formula of 1-Benzyl-5,5-diethylbarbituric acid?
The molecular formula of 1-Benzyl-5,5-diethylbarbituric acid is C15H18N2O3.
What is the molecular weight of 1-Benzyl-5,5-diethylbarbituric acid?
The molecular weight of 1-Benzyl-5,5-diethylbarbituric acid is 274.13 g/mol.
Where can I buy 1-Benzyl-5,5-diethylbarbituric acid?
You can request a quote for 1-Benzyl-5,5-diethylbarbituric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-5,5-diethylbarbituric acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-5,5-diethylbarbituric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.