(E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 577696-56-1) is a chemical compound with molecular formula C20H18FN3O4 and molecular weight 383.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[C-ethyl-N-(4-fluorophenyl)carbonimidoyl]-6-hydroxy-1-(4-methoxyphenyl)pyrimidine-2,4-dione
Also Known As: (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-5-[1-(4-fluoroanilino)propylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione, 5-[1-(4-fluoroanilino)propylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione, (5E)-5-{1-[(4-fluorophenyl)amino]propylidene}-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C20H18FN3O4 |
|---|---|
| Molecular Weight | 383.13 g/mol |
| LogP | 2.9099 |
| Topological Polar Surface Area | 96.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.12814 |
| Heavy Atoms | 28 |
| Complexity | 1130.0978 |
Chemical Identifiers
| CAS Number | 577696-56-1 |
|---|---|
| SMILES | CCC(=NC1=CC=C(C=C1)F)C2=C(N(C(=O)NC2=O)C3=CC=C(C=C3)OC)O |
Product Overview
(E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 577696-56-1), with molecular formula C20H18FN3O4 and molecular weight 383.13 g/mol. IUPAC: 5-[C-ethyl-N-(4-fluorophenyl)carbonimidoyl]-6-hydroxy-1-(4-methoxyphenyl)pyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.9099 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 96.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)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-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 577696-56-1.
What is the molecular formula of (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C20H18FN3O4.
What is the molecular weight of (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 383.13 g/mol.
Where can I buy (E)-5-(1-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-(1-((4-fluorophenyl)amino)propylidene)-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-((4-fluorophenyl)amino)propylidene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(1-((4-fluorophenyl)amino)propylidene)-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.