Barbituric acid, 5-isopentyl-5-vinyl-
TL;DR: Barbituric acid, 5-isopentyl-5-vinyl- (CAS 67051-34-7) is a chemical compound with molecular formula C11H16N2O3 and molecular weight 224.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethenyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione
Also Known As: 5-Isopentyl-5-vinylbarbituric acid, BARBITURIC ACID, 5-ISOPENTYL-5-VINYL-, 5-24-09-00230 (Beilstein Handbook Reference), 5-ethenyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione, 5-Isopentyl-5-vinyl-2,4,6(1H,3H,5H)-pyrimidinetrione
| Molecular Formula | C11H16N2O3 |
|---|---|
| Molecular Weight | 224.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.11609 |
| Heavy Atoms | 16 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 67051-34-7 |
|---|---|
| SMILES | CC(C)CCC1(C(=O)NC(=O)NC1=O)C=C |
| InChIKey | JYKMNZIAWVDMDX-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 5-isopentyl-5-vinyl- (CAS 67051-34-7), with molecular formula C11H16N2O3 and molecular weight 224.12 g/mol. IUPAC: 5-ethenyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 5-isopentyl-5-vinyl-
Property Insights of Barbituric acid, 5-isopentyl-5-vinyl-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 5-isopentyl-5-vinyl-. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5-isopentyl-5-vinyl-. Following Lipinski's Rule of Five, Barbituric acid, 5-isopentyl-5-vinyl- 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
Frequently Asked Questions
What is the CAS number of Barbituric acid, 5-isopentyl-5-vinyl-?
The CAS number of Barbituric acid, 5-isopentyl-5-vinyl- is 67051-34-7.
What is the molecular formula of Barbituric acid, 5-isopentyl-5-vinyl-?
The molecular formula of Barbituric acid, 5-isopentyl-5-vinyl- is C11H16N2O3.
What is the molecular weight of Barbituric acid, 5-isopentyl-5-vinyl-?
The molecular weight of Barbituric acid, 5-isopentyl-5-vinyl- is 224.12 g/mol.
Where can I buy Barbituric acid, 5-isopentyl-5-vinyl-?
You can request a quote for Barbituric acid, 5-isopentyl-5-vinyl- 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-isopentyl-5-vinyl-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5-isopentyl-5-vinyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.