(E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 713084-47-0) is a chemical compound with molecular formula C20H18ClN3O5 and molecular weight 415.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-chloro-4-methoxyphenyl)iminomethyl]-1-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4-dione
Also Known As: (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[(3-chloro-4-methoxyanilino)methylidene]-1-(4-ethoxyphenyl)-1,3-diazinane-2,4,6-trione, (5E)-5-[(3-chloro-4-methoxyanilino)methylidene]-1-(4-ethoxyphenyl)-1,3-diazinane-2,4,6-trione, (5E)-5-{[(3-chloro-4-methoxyphenyl)amino]methylidene}-3-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C20H18ClN3O5 |
|---|---|
| Molecular Weight | 415.09 g/mol |
| LogP | 3.0427 |
| Topological Polar Surface Area | 105.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.0935 |
| Heavy Atoms | 29 |
| Complexity | 1166.2147 |
Chemical Identifiers
| CAS Number | 713084-47-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)C=NC3=CC(=C(C=C3)OC)Cl)O |
Product Overview
(E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 713084-47-0), with molecular formula C20H18ClN3O5 and molecular weight 415.09 g/mol. IUPAC: 5-[(3-chloro-4-methoxyphenyl)iminomethyl]-1-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 3.0427 indicates that (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.91 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione has 2 hydrogen bond donor(s) and 6 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 (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 713084-47-0.
What is the molecular formula of (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C20H18ClN3O5.
What is the molecular weight of (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 415.09 g/mol.
Where can I buy (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)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 (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(((3-chloro-4-methoxyphenyl)amino)methylene)-1-(4-ethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.