Barbituric acid, 5,5-diallyl-1-phenethyl-
TL;DR: Barbituric acid, 5,5-diallyl-1-phenethyl- (CAS 34486-71-0) is a chemical compound with molecular formula C18H20N2O3 and molecular weight 312.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-phenylethyl)-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
Also Known As: 5,5-Diallyl-1-phenethylbarbituric acid, BARBITURIC ACID, 5,5-DIALLYL-1-PHENETHYL-, 5-24-09-00248 (Beilstein Handbook Reference), 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-(2-phenylethyl)-5,5-di-2-propenyl-, 1-(2-Phenylethyl)-5,5-di(2-propenyl)barbituric acid
| Molecular Formula | C18H20N2O3 |
|---|---|
| Molecular Weight | 312.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 312.1474 |
| Heavy Atoms | 23 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 34486-71-0 |
|---|---|
| SMILES | C=CCC1(C(=O)NC(=O)N(C1=O)CCC2=CC=CC=C2)CC=C |
| InChIKey | DLKVITCFMFWCSL-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 5,5-diallyl-1-phenethyl- (CAS 34486-71-0), with molecular formula C18H20N2O3 and molecular weight 312.15 g/mol. IUPAC: 1-(2-phenylethyl)-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 5,5-diallyl-1-phenethyl-
Property Insights of Barbituric acid, 5,5-diallyl-1-phenethyl-
The XLogP value of 3.5 indicates that Barbituric acid, 5,5-diallyl-1-phenethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5,5-diallyl-1-phenethyl-. Following Lipinski's Rule of Five, Barbituric acid, 5,5-diallyl-1-phenethyl- 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 Barbituric acid, 5,5-diallyl-1-phenethyl-?
The CAS number of Barbituric acid, 5,5-diallyl-1-phenethyl- is 34486-71-0.
What is the molecular formula of Barbituric acid, 5,5-diallyl-1-phenethyl-?
The molecular formula of Barbituric acid, 5,5-diallyl-1-phenethyl- is C18H20N2O3.
What is the molecular weight of Barbituric acid, 5,5-diallyl-1-phenethyl-?
The molecular weight of Barbituric acid, 5,5-diallyl-1-phenethyl- is 312.15 g/mol.
Where can I buy Barbituric acid, 5,5-diallyl-1-phenethyl-?
You can request a quote for Barbituric acid, 5,5-diallyl-1-phenethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barbituric acid, 5,5-diallyl-1-phenethyl-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5,5-diallyl-1-phenethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.