Barbituric acid, 5-butyl-5-(cycloocten-1-yl)-
TL;DR: Barbituric acid, 5-butyl-5-(cycloocten-1-yl)- (CAS 81773-35-5) is a chemical compound with molecular formula C16H24N2O3 and molecular weight 292.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butyl-5-[(1E)-cycloocten-1-yl]-1,3-diazinane-2,4,6-trione
Also Known As: 5-Butyl-5-cycloheptenylbarbituric acid, 5-Butyl-5-cyclooctenylbarbitursaeure, 5-Butyl-5-cyclooctenylbarbitursaeure [German], B 103, delta-1-Cyclooctenyl-butyl-barbitursaeure
| Molecular Formula | C16H24N2O3 |
|---|---|
| Molecular Weight | 292.18 g/mol |
| LogP | 2.8096 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.17868 |
| Heavy Atoms | 21 |
| Complexity | 448.14255 |
Chemical Identifiers
| CAS Number | 81773-35-5 |
|---|---|
| SMILES | CCCCC1(C(=O)NC(=O)NC1=O)/C/2=C/CCCCCC2 |
Product Overview
Barbituric acid, 5-butyl-5-(cycloocten-1-yl)- (CAS 81773-35-5), with molecular formula C16H24N2O3 and molecular weight 292.18 g/mol. IUPAC: 5-butyl-5-[(1E)-cycloocten-1-yl]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 5-butyl-5-(cycloocten-1-yl)-
Property Insights of Barbituric acid, 5-butyl-5-(cycloocten-1-yl)-
The XLogP value of 2.8096 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 5-butyl-5-(cycloocten-1-yl)-. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5-butyl-5-(cycloocten-1-yl)-. Following Lipinski's Rule of Five, Barbituric acid, 5-butyl-5-(cycloocten-1-yl)- 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-butyl-5-(cycloocten-1-yl)-?
The CAS number of Barbituric acid, 5-butyl-5-(cycloocten-1-yl)- is 81773-35-5.
What is the molecular formula of Barbituric acid, 5-butyl-5-(cycloocten-1-yl)-?
The molecular formula of Barbituric acid, 5-butyl-5-(cycloocten-1-yl)- is C16H24N2O3.
What is the molecular weight of Barbituric acid, 5-butyl-5-(cycloocten-1-yl)-?
The molecular weight of Barbituric acid, 5-butyl-5-(cycloocten-1-yl)- is 292.18 g/mol.
Where can I buy Barbituric acid, 5-butyl-5-(cycloocten-1-yl)-?
You can request a quote for Barbituric acid, 5-butyl-5-(cycloocten-1-yl)- 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-butyl-5-(cycloocten-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5-butyl-5-(cycloocten-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.