![5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/295/295361-16-9.png)
5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione
TL;DR: 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione (CAS 295361-16-9) is a chemical compound with molecular formula C12H8F3N3O3 and molecular weight 299.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-5-[[3-(trifluoromethyl)phenyl]iminomethyl]-1H-pyrimidine-2,4-dione
Also Known As: 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione, 5-(((3-(trifluoromethyl)phenyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-({[3-(trifluoromethyl)phenyl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C12H8F3N3O3 |
|---|---|
| Molecular Weight | 299.05 g/mol |
| LogP | 1.5382 |
| Topological Polar Surface Area | 98.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.0518 |
| Heavy Atoms | 21 |
| Complexity | 805.61566 |
Chemical Identifiers
| CAS Number | 295361-16-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N=CC2=C(NC(=O)NC2=O)O)C(F)(F)F |
Product Overview
5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione (CAS 295361-16-9), with molecular formula C12H8F3N3O3 and molecular weight 299.05 g/mol. IUPAC: 6-hydroxy-5-[[3-(trifluoromethyl)phenyl]iminomethyl]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione
Property Insights of 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 1.5382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 98.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-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-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione is 295361-16-9.
What is the molecular formula of 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione is C12H8F3N3O3.
What is the molecular weight of 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione is 299.05 g/mol.
Where can I buy 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-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-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[[3-(trifluoromethyl)anilino]methylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.