5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione (CAS 313688-38-9) is a chemical compound with molecular formula C14H14FN3O3 and molecular weight 291.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[N-(4-fluorophenyl)-C-methylcarbonimidoyl]-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
Also Known As: 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione, 5-(1-((4-fluorophenyl)amino)ethylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione, 5-[1-(4-fluoroanilino)ethylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C14H14FN3O3 |
|---|---|
| Molecular Weight | 291.10 g/mol |
| LogP | 1.0694 |
| Topological Polar Surface Area | 76.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.10193 |
| Heavy Atoms | 21 |
| Complexity | 832.2684 |
Chemical Identifiers
| CAS Number | 313688-38-9 |
|---|---|
| SMILES | CC(=NC1=CC=C(C=C1)F)C2=C(N(C(=O)N(C2=O)C)C)O |
Product Overview
5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione (CAS 313688-38-9), with molecular formula C14H14FN3O3 and molecular weight 291.10 g/mol. IUPAC: 5-[N-(4-fluorophenyl)-C-methylcarbonimidoyl]-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 1.0694 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 76.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione has 1 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 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione is 313688-38-9.
What is the molecular formula of 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione is C14H14FN3O3.
What is the molecular weight of 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione is 291.10 g/mol.
Where can I buy 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-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 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-{1-[(4-fluorophenyl)amino]ethylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.