Barbituric acid, 1-butyl-5,5-diallyl-
TL;DR: Barbituric acid, 1-butyl-5,5-diallyl- (CAS 30453-93-1) is a chemical compound with molecular formula C14H20N2O3 and molecular weight 264.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
Also Known As: Barbituric acid, 1-butyl-5,5-diallyl-, Barbituric acid, 1-butyl-5,5-diallyl-,, 1-butyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione, 1-Butyl-5,5-di(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione, RefChem:320629
| Molecular Formula | C14H20N2O3 |
|---|---|
| Molecular Weight | 264.15 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 264.1474 |
| Heavy Atoms | 19 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 30453-93-1 |
|---|---|
| SMILES | CCCCN1C(=O)C(C(=O)NC1=O)(CC=C)CC=C |
| InChIKey | WRPKWNHHRIEDDI-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 1-butyl-5,5-diallyl- (CAS 30453-93-1), with molecular formula C14H20N2O3 and molecular weight 264.15 g/mol. IUPAC: 1-butyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 1-butyl-5,5-diallyl-
Property Insights of Barbituric acid, 1-butyl-5,5-diallyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 1-butyl-5,5-diallyl-. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 1-butyl-5,5-diallyl-. Following Lipinski's Rule of Five, Barbituric acid, 1-butyl-5,5-diallyl- 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, 1-butyl-5,5-diallyl-?
The CAS number of Barbituric acid, 1-butyl-5,5-diallyl- is 30453-93-1.
What is the molecular formula of Barbituric acid, 1-butyl-5,5-diallyl-?
The molecular formula of Barbituric acid, 1-butyl-5,5-diallyl- is C14H20N2O3.
What is the molecular weight of Barbituric acid, 1-butyl-5,5-diallyl-?
The molecular weight of Barbituric acid, 1-butyl-5,5-diallyl- is 264.15 g/mol.
Where can I buy Barbituric acid, 1-butyl-5,5-diallyl-?
You can request a quote for Barbituric acid, 1-butyl-5,5-diallyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barbituric acid, 1-butyl-5,5-diallyl-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 1-butyl-5,5-diallyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.