5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 258347-77-2) is a chemical compound with molecular formula C13H12N2O4 and molecular weight 260.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-ethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: BAS 00689326, 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-(4-ethoxybenzylidene)hexahydropyrimidine-2,4,6-trione, 5-(4-Ethoxy-benzylidene)-pyrimidine-2,4,6-trione, 5-[(4-ethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C13H12N2O4 |
|---|---|
| Molecular Weight | 260.08 g/mol |
| LogP | 0.8347 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.0797 |
| Heavy Atoms | 19 |
| Complexity | 538.51086 |
Chemical Identifiers
| CAS Number | 258347-77-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C=C2C(=O)NC(=O)NC2=O |
Product Overview
5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 258347-77-2), with molecular formula C13H12N2O4 and molecular weight 260.08 g/mol. IUPAC: 5-[(4-ethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 0.8347 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione 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-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 258347-77-2.
What is the molecular formula of 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is C13H12N2O4.
What is the molecular weight of 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 260.08 g/mol.
Where can I buy 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-ethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.