(5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid
TL;DR: (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid (CAS 342015-24-1) is a chemical compound with molecular formula C22H21N3O4 and molecular weight 391.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-1-(3-methylphenyl)-5-[(4-morpholin-4-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid, (5E)-1-(3-methylphenyl)-5-[(4-morpholin-4-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione, 5-[1-(4-Morpholin-4-yl-phenyl)-meth-(E)-ylidene]-1-m-tolyl-pyrimidine-2,4,6-trione, (E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-1-(3-methylphenyl)-5-[[4-(4-morpholinyl)phenyl]methylidene]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C22H21N3O4 |
|---|---|
| Molecular Weight | 391.15 g/mol |
| LogP | 2.49802 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.1532 |
| Heavy Atoms | 29 |
| Complexity | 991.3719 |
Chemical Identifiers
| CAS Number | 342015-24-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)/C(=C/C3=CC=C(C=C3)N4CCOCC4)/C(=O)NC2=O |
Product Overview
(5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid (CAS 342015-24-1), with molecular formula C22H21N3O4 and molecular weight 391.15 g/mol. IUPAC: (5E)-1-(3-methylphenyl)-5-[(4-morpholin-4-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid
Property Insights of (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid
The XLogP value of 2.49802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid. The TPSA of 78.95 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid. Following Lipinski's Rule of Five, (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid has 1 hydrogen bond donor(s) and 5 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 (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid?
The CAS number of (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid is 342015-24-1.
What is the molecular formula of (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid?
The molecular formula of (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid is C22H21N3O4.
What is the molecular weight of (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid?
The molecular weight of (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid is 391.15 g/mol.
Where can I buy (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid?
You can request a quote for (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-(4-morpholinobenzylidene)-1-(m-tolyl)barbituric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.