1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
TL;DR: 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 372979-10-7) is a chemical compound with molecular formula C22H22N2O8 and molecular weight 442.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-1-(2,5-dimethoxyphenyl)-5-[(2,4,5-trimethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione, (5Z)-1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, (5Z)-1-(2,5-dimethoxyphenyl)-5-[(2,4,5-trimethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione, (Z)-1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C22H22N2O8 |
|---|---|
| Molecular Weight | 442.14 g/mol |
| LogP | 2.396 |
| Topological Polar Surface Area | 112.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.1376 |
| Heavy Atoms | 32 |
| Complexity | 1109.35 |
Chemical Identifiers
| CAS Number | 372979-10-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)N2C(=O)/C(=C\C3=CC(=C(C=C3OC)OC)OC)/C(=O)NC2=O |
Product Overview
1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 372979-10-7), with molecular formula C22H22N2O8 and molecular weight 442.14 g/mol. IUPAC: (5Z)-1-(2,5-dimethoxyphenyl)-5-[(2,4,5-trimethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
Property Insights of 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
The XLogP value of 2.396 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione. The TPSA of 112.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione. Following Lipinski's Rule of Five, 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione has 1 hydrogen bond donor(s) and 8 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 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione?
The CAS number of 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione is 372979-10-7.
What is the molecular formula of 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular formula of 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione is C22H22N2O8.
What is the molecular weight of 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular weight of 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione is 442.14 g/mol.
Where can I buy 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione?
You can request a quote for 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-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 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,5-dimethoxyphenyl)-5-(2,4,5-trimethoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.