(E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 577985-39-8) is a chemical compound with molecular formula C18H24N4O4 and molecular weight 360.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[N-[3-(dimethylamino)propyl]-C-methylcarbonimidoyl]-6-hydroxy-1-(4-methoxyphenyl)pyrimidine-2,4-dione
Also Known As: (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-5-(1-{[3-(dimethylamino)propyl]amino}ethylidene)-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione, (5E)-5-[1-[3-(dimethylamino)propylamino]ethylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione, 5-[1-(3-dimethylaminopropylamino)ethylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione, 5-[1-[3-(dimethylamino)propylamino]ethylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C18H24N4O4 |
|---|---|
| Molecular Weight | 360.18 g/mol |
| LogP | 1.0007 |
| Topological Polar Surface Area | 99.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 360.17975 |
| Heavy Atoms | 26 |
| Complexity | 894.88763 |
Chemical Identifiers
| CAS Number | 577985-39-8 |
|---|---|
| SMILES | CC(=NCCCN(C)C)C1=C(N(C(=O)NC1=O)C2=CC=C(C=C2)OC)O |
Product Overview
(E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 577985-39-8), with molecular formula C18H24N4O4 and molecular weight 360.18 g/mol. IUPAC: 5-[N-[3-(dimethylamino)propyl]-C-methylcarbonimidoyl]-6-hydroxy-1-(4-methoxyphenyl)pyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 1.0007 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 99.92 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)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-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 577985-39-8.
What is the molecular formula of (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C18H24N4O4.
What is the molecular weight of (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 360.18 g/mol.
Where can I buy (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)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-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(1-((3-(dimethylamino)propyl)amino)ethylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.