(E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 840518-79-8) is a chemical compound with molecular formula C21H22N4O3 and molecular weight 378.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[N-[4-(dimethylamino)phenyl]-C-methylcarbonimidoyl]-6-hydroxy-1-(4-methylphenyl)pyrimidine-2,4-dione
Also Known As: (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[1-[4-(dimethylamino)anilino]ethylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione, (5E)-5-(1-{[4-(dimethylamino)phenyl]amino}ethylidene)-6-hydroxy-3-(4-methylphenyl)pyrimidine-2,4(3H,5H)-dione, (5E)-5-[1-[4-(dimethylamino)anilino]ethylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C21H22N4O3 |
|---|---|
| Molecular Weight | 378.17 g/mol |
| LogP | 2.74652 |
| Topological Polar Surface Area | 90.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.1692 |
| Heavy Atoms | 28 |
| Complexity | 1138.2535 |
Chemical Identifiers
| CAS Number | 840518-79-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)C(=NC3=CC=C(C=C3)N(C)C)C)O |
Product Overview
(E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 840518-79-8), with molecular formula C21H22N4O3 and molecular weight 378.17 g/mol. IUPAC: 5-[N-[4-(dimethylamino)phenyl]-C-methylcarbonimidoyl]-6-hydroxy-1-(4-methylphenyl)pyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.74652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 90.69 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione has 2 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 (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 840518-79-8.
What is the molecular formula of (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C21H22N4O3.
What is the molecular weight of (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 378.17 g/mol.
Where can I buy (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)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-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(1-((4-(dimethylamino)phenyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.