5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
TL;DR: 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 23450-43-3) is a chemical compound with molecular formula C12H10N2O4 and molecular weight 246.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-methoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: 5-(2-Methoxybenzylidene)barbituric acid, BAS 00393629, J1.289.311F, 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione, 5-(2-methoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C12H10N2O4 |
|---|---|
| Molecular Weight | 246.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.06406 |
| Heavy Atoms | 18 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 23450-43-3 |
|---|---|
| SMILES | COC1=CC=CC=C1C=C2C(=O)NC(=O)NC2=O |
| InChIKey | AYVCVCZXKMIXRW-UHFFFAOYSA-N |
Product Overview
5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 23450-43-3), with molecular formula C12H10N2O4 and molecular weight 246.06 g/mol. IUPAC: 5-[(2-methoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
Property Insights of 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione. Following Lipinski's Rule of Five, 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione has 2 hydrogen bond donor(s) and 4 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 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione?
The CAS number of 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione is 23450-43-3.
What is the molecular formula of 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular formula of 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione is C12H10N2O4.
What is the molecular weight of 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular weight of 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione is 246.06 g/mol.
Where can I buy 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione?
You can request a quote for 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.