(E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione (CAS 347397-58-4) is a chemical compound with molecular formula C19H14Cl2N2O4 and molecular weight 404.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(3,5-dichloro-4-phenylmethoxyphenyl)methylidene]-1-methyl-1,3-diazinane-2,4,6-trione
Also Known As: (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione, 5-[4-(benzyloxy)-3,5-dichlorobenzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione, (5E)-5-[(3,5-dichloro-4-phenylmethoxyphenyl)methylidene]-1-methyl-1,3-diazinane-2,4,6-trione, (5E)-5-[4-(benzyloxy)-3,5-dichlorobenzylidene]-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C19H14Cl2N2O4 |
|---|---|
| Molecular Weight | 404.03 g/mol |
| LogP | 3.664 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.03305 |
| Heavy Atoms | 27 |
| Complexity | 934.43207 |
Chemical Identifiers
| CAS Number | 347397-58-4 |
|---|---|
| SMILES | CN1C(=O)/C(=C/C2=CC(=C(C(=C2)Cl)OCC3=CC=CC=C3)Cl)/C(=O)NC1=O |
Product Overview
(E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione (CAS 347397-58-4), with molecular formula C19H14Cl2N2O4 and molecular weight 404.03 g/mol. IUPAC: (5E)-5-[(3,5-dichloro-4-phenylmethoxyphenyl)methylidene]-1-methyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 3.664 indicates that (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione has 1 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 (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione is 347397-58-4.
What is the molecular formula of (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione is C19H14Cl2N2O4.
What is the molecular weight of (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione is 404.03 g/mol.
Where can I buy (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-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-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(4-(benzyloxy)-3,5-dichlorobenzylidene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.