![5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione structure](/static/products/3375/337502-96-2.webp)
5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 337502-96-2) is a chemical compound with molecular formula C11H8FN3O3 and molecular weight 249.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-fluorophenyl)iminomethyl]-6-hydroxy-1H-pyrimidine-2,4-dione
Also Known As: BAS 01355505, 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[(3-Fluoro-phenylamino)-methylene]-pyrimidine-2,4,6-trione, 5-[(3-fluoroanilino)methylidene]-1,3-diazinane-2,4,6-trione, 5-(((3-fluorophenyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C11H8FN3O3 |
|---|---|
| Molecular Weight | 249.05 g/mol |
| LogP | 0.6585 |
| Topological Polar Surface Area | 98.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.05496 |
| Heavy Atoms | 18 |
| Complexity | 717.95874 |
Chemical Identifiers
| CAS Number | 337502-96-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)N=CC2=C(NC(=O)NC2=O)O |
Product Overview
5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 337502-96-2), with molecular formula C11H8FN3O3 and molecular weight 249.05 g/mol. IUPAC: 5-[(3-fluorophenyl)iminomethyl]-6-hydroxy-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 0.6585 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 98.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione 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 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione is 337502-96-2.
What is the molecular formula of 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione is C11H8FN3O3.
What is the molecular weight of 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione is 249.05 g/mol.
Where can I buy 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for 5-{[(3-fluorophenyl)amino]methylidene}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 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-{[(3-fluorophenyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.