![1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione structure](/static/products/313/313688-44-7.png)
1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
TL;DR: 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 313688-44-7) is a chemical compound with molecular formula C14H12FN3O3 and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-fluorophenyl)iminomethyl]-6-hydroxy-1-prop-2-enylpyrimidine-2,4-dione
Also Known As: 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione, (5E)-5-[(4-fluoroanilino)methylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione, (5Z)-5-[(4-fluoroanilino)methylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione, (Z)-1-allyl-5-(((4-fluorophenyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[(4-fluoroanilino)methylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C14H12FN3O3 |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | 1.3179 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.08627 |
| Heavy Atoms | 21 |
| Complexity | 803.69446 |
Chemical Identifiers
| CAS Number | 313688-44-7 |
|---|---|
| SMILES | C=CCN1C(=C(C(=O)NC1=O)C=NC2=CC=C(C=C2)F)O |
Product Overview
1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 313688-44-7), with molecular formula C14H12FN3O3 and molecular weight 289.09 g/mol. IUPAC: 5-[(4-fluorophenyl)iminomethyl]-6-hydroxy-1-prop-2-enylpyrimidine-2,4-dione.
Chemical Property Profile of 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Property Insights of 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
The XLogP value of 1.3179 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione. The TPSA of 87.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione. Following Lipinski's Rule of Five, 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione has 2 hydrogen bond donor(s) and 4 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 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione?
The CAS number of 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione is 313688-44-7.
What is the molecular formula of 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular formula of 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione is C14H12FN3O3.
What is the molecular weight of 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular weight of 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione is 289.09 g/mol.
Where can I buy 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione?
You can request a quote for 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione?
Yes, KEHONG BIO provides custom synthesis services for 1-allyl-5-{[(4-fluorophenyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.