![5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione structure](/static/products/5960/5960-64-5.webp)
5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
TL;DR: 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 5960-64-5) is a chemical compound with molecular formula C14H14BrN3O3 and molecular weight 351.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione, (5Z)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C14H14BrN3O3 |
|---|---|
| Molecular Weight | 351.02 g/mol |
| LogP | 1.6067 |
| Topological Polar Surface Area | 69.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.02185 |
| Heavy Atoms | 21 |
| Complexity | 667.4281 |
Chemical Identifiers
| CAS Number | 5960-64-5 |
|---|---|
| SMILES | CN1C(=O)/C(=C\C2=CC(=C(C=C2)N(C)C)Br)/C(=O)NC1=O |
Product Overview
5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 5960-64-5), with molecular formula C14H14BrN3O3 and molecular weight 351.02 g/mol. IUPAC: (5Z)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Property Insights of 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
The XLogP value of 1.6067 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione. The TPSA of 69.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione. Following Lipinski's Rule of Five, 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione 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-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
The CAS number of 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione is 5960-64-5.
What is the molecular formula of 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular formula of 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione is C14H14BrN3O3.
What is the molecular weight of 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular weight of 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione is 351.02 g/mol.
Where can I buy 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
You can request a quote for 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-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 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione?
Yes, KEHONG BIO provides custom synthesis services for 5-[3-bromo-4-(dimethylamino)benzylidene]-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.