(E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 713092-91-2) is a chemical compound with molecular formula C21H18FN3O4 and molecular weight 395.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-1-(3-fluorophenyl)-5-[(4-morpholin-4-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-1-(3-fluorophenyl)-5-[(4-morpholin-4-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione, (5E)-3-(3-fluorophenyl)-6-hydroxy-5-[4-(morpholin-4-yl)benzylidene]pyrimidine-2,4(3H,5H)-dione, 1-(3-Fluoro-phenyl)-5-[1-(4-morpholin-4-yl-phenyl)-meth-(E)-ylidene]-pyrimidine-2,4,6-trione
| Molecular Formula | C21H18FN3O4 |
|---|---|
| Molecular Weight | 395.13 g/mol |
| LogP | 2.3287 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.12814 |
| Heavy Atoms | 29 |
| Complexity | 997.2407 |
Chemical Identifiers
| CAS Number | 713092-91-2 |
|---|---|
| SMILES | C1COCCN1C2=CC=C(C=C2)/C=C/3\C(=O)NC(=O)N(C3=O)C4=CC(=CC=C4)F |
Product Overview
(E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 713092-91-2), with molecular formula C21H18FN3O4 and molecular weight 395.13 g/mol. IUPAC: (5E)-1-(3-fluorophenyl)-5-[(4-morpholin-4-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.3287 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 78.95 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)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)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 713092-91-2.
What is the molecular formula of (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is C21H18FN3O4.
What is the molecular weight of (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 395.13 g/mol.
Where can I buy (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)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)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-(3-fluorophenyl)-5-(4-morpholinobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.