(E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 373616-83-2) is a chemical compound with molecular formula C21H19FN2O5 and molecular weight 398.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(2,5-dimethoxyphenyl)methylidene]-1-[2-(4-fluorophenyl)ethyl]-1,3-diazinane-2,4,6-trione
Also Known As: (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-5-(2,5-dimethoxybenzylidene)-1-[2-(4-fluorophenyl)ethyl]-2-hydroxypyrimidine-4,6(1H,5H)-dione, (5E)-5-[(2,5-dimethoxyphenyl)methylidene]-1-[2-(4-fluorophenyl)ethyl]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C21H19FN2O5 |
|---|---|
| Molecular Weight | 398.13 g/mol |
| LogP | 2.5474 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.1278 |
| Heavy Atoms | 29 |
| Complexity | 985.06604 |
Chemical Identifiers
| CAS Number | 373616-83-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)/C=C/2\C(=O)NC(=O)N(C2=O)CCC3=CC=C(C=C3)F |
Product Overview
(E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 373616-83-2), with molecular formula C21H19FN2O5 and molecular weight 398.13 g/mol. IUPAC: (5E)-5-[(2,5-dimethoxyphenyl)methylidene]-1-[2-(4-fluorophenyl)ethyl]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.5474 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione 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 (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 373616-83-2.
What is the molecular formula of (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C21H19FN2O5.
What is the molecular weight of (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 398.13 g/mol.
Where can I buy (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)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-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(2,5-dimethoxybenzylidene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.