![(5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one structure](/static/products/577/577694-89-4.png)
(5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one
TL;DR: (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one (CAS 577694-89-4) is a chemical compound with molecular formula C13H12FN3O3 and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[N-[(4-fluorophenyl)methyl]-C-methylcarbonimidoyl]-6-hydroxy-1H-pyrimidine-2,4-dione
Also Known As: 5-[1-[(4-fluorophenyl)methylamino]ethylidene]-1,3-diazinane-2,4,6-trione, 5-(1-((4-fluorobenzyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one
| Molecular Formula | C13H12FN3O3 |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 0.9171 |
| Topological Polar Surface Area | 98.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.08627 |
| Heavy Atoms | 20 |
| Complexity | 759.6662 |
Chemical Identifiers
| CAS Number | 577694-89-4 |
|---|---|
| SMILES | CC(=NCC1=CC=C(C=C1)F)C2=C(NC(=O)NC2=O)O |
Product Overview
(5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one (CAS 577694-89-4), with molecular formula C13H12FN3O3 and molecular weight 277.09 g/mol. IUPAC: 5-[N-[(4-fluorophenyl)methyl]-C-methylcarbonimidoyl]-6-hydroxy-1H-pyrimidine-2,4-dione.
Chemical Property Profile of (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one
Property Insights of (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one
The XLogP value of 0.9171 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one. The TPSA of 98.31 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one. Following Lipinski's Rule of Five, (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one has 3 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 (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one?
The CAS number of (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one is 577694-89-4.
What is the molecular formula of (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one?
The molecular formula of (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one is C13H12FN3O3.
What is the molecular weight of (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one?
The molecular weight of (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one is 277.09 g/mol.
Where can I buy (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one?
You can request a quote for (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,6-dihydroxypyrimidin-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.