1,3-Diethyl-5,5-dimethylbarbituric acid
TL;DR: 1,3-Diethyl-5,5-dimethylbarbituric acid (CAS 736156-92-6) is a chemical compound with molecular formula C10H16N2O3 and molecular weight 212.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diethyl-5,5-dimethyl-1,3-diazinane-2,4,6-trione
Also Known As: NIOSH/CQ3508500, 1,3-Diethyl-5,5-dimethylbarbituric acid, Barbituric acid, 1,3-diethyl-5,5-dimethyl-, Barbituric acid, 1,3-diethyl-5,5-dimethyl- (4CI), 1,3-diethyl-5,5-dimethyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C10H16N2O3 |
|---|---|
| Molecular Weight | 212.12 g/mol |
| LogP | 0.8432 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.11609 |
| Heavy Atoms | 15 |
| Complexity | 294.62918 |
Chemical Identifiers
| CAS Number | 736156-92-6 |
|---|---|
| SMILES | CCN1C(=O)C(C(=O)N(C1=O)CC)(C)C |
Product Overview
1,3-Diethyl-5,5-dimethylbarbituric acid (CAS 736156-92-6), with molecular formula C10H16N2O3 and molecular weight 212.12 g/mol. IUPAC: 1,3-diethyl-5,5-dimethyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 1,3-Diethyl-5,5-dimethylbarbituric acid
Property Insights of 1,3-Diethyl-5,5-dimethylbarbituric acid
The XLogP value of 0.8432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Diethyl-5,5-dimethylbarbituric acid. With a topological polar surface area (TPSA) of 57.69 Ų, 1,3-Diethyl-5,5-dimethylbarbituric acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Diethyl-5,5-dimethylbarbituric acid has 0 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 1,3-Diethyl-5,5-dimethylbarbituric acid?
The CAS number of 1,3-Diethyl-5,5-dimethylbarbituric acid is 736156-92-6.
What is the molecular formula of 1,3-Diethyl-5,5-dimethylbarbituric acid?
The molecular formula of 1,3-Diethyl-5,5-dimethylbarbituric acid is C10H16N2O3.
What is the molecular weight of 1,3-Diethyl-5,5-dimethylbarbituric acid?
The molecular weight of 1,3-Diethyl-5,5-dimethylbarbituric acid is 212.12 g/mol.
Where can I buy 1,3-Diethyl-5,5-dimethylbarbituric acid?
You can request a quote for 1,3-Diethyl-5,5-dimethylbarbituric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diethyl-5,5-dimethylbarbituric acid?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diethyl-5,5-dimethylbarbituric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.