Barbituric acid, 5-nonyl-
TL;DR: Barbituric acid, 5-nonyl- (CAS 14077-86-2) is a chemical compound with molecular formula C13H22N2O3 and molecular weight 254.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nonyl-1,3-diazinane-2,4,6-trione
Also Known As: Barbituric acid, 5-nonyl-, 5-Nonylbarbituric acid, n-nonyl barbituric acid, 5-nonyl-1,3-diazinane-2,4,6-trione, NCIOpen2_005893
| Molecular Formula | C13H22N2O3 |
|---|---|
| Molecular Weight | 254.16 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 254.16304 |
| Heavy Atoms | 18 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 14077-86-2 |
|---|---|
| SMILES | CCCCCCCCCC1C(=O)NC(=O)NC1=O |
| InChIKey | PDFZDDDFBSFXNI-UHFFFAOYSA-N |
Product Overview
Barbituric acid, 5-nonyl- (CAS 14077-86-2), with molecular formula C13H22N2O3 and molecular weight 254.16 g/mol. IUPAC: 5-nonyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of Barbituric acid, 5-nonyl-
Property Insights of Barbituric acid, 5-nonyl-
The XLogP value of 3.5 indicates that Barbituric acid, 5-nonyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5-nonyl-. Following Lipinski's Rule of Five, Barbituric acid, 5-nonyl- 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-nonyl-?
The CAS number of Barbituric acid, 5-nonyl- is 14077-86-2.
What is the molecular formula of Barbituric acid, 5-nonyl-?
The molecular formula of Barbituric acid, 5-nonyl- is C13H22N2O3.
What is the molecular weight of Barbituric acid, 5-nonyl-?
The molecular weight of Barbituric acid, 5-nonyl- is 254.16 g/mol.
Where can I buy Barbituric acid, 5-nonyl-?
You can request a quote for Barbituric acid, 5-nonyl- 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-nonyl-?
Yes, KEHONG BIO provides custom synthesis services for Barbituric acid, 5-nonyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.