![4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid structure](/static/products/6954/6954-05-8.webp)
4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid
TL;DR: 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid (CAS 6954-05-8) is a chemical compound with molecular formula C14H11BrN4O3 and molecular weight 362.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid
Also Known As: 2-Butenoicacid, 4-[2-(5-bromo-1,6-dihydro-6-oxo-4-pyridazinyl)hydrazinylidene]-4-phenyl-, 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid
| Molecular Formula | C14H11BrN4O3 |
|---|---|
| Molecular Weight | 362.00 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.00146 |
| Heavy Atoms | 22 |
| Complexity | 575.0 |
Chemical Identifiers
| CAS Number | 6954-05-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=NNC2=C(C(=O)NN=C2)Br)C=CC(=O)O |
| InChIKey | VWJBRYKNLZOOKB-UHFFFAOYSA-N |
Product Overview
4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid (CAS 6954-05-8), with molecular formula C14H11BrN4O3 and molecular weight 362.00 g/mol. IUPAC: 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid.
Chemical Property Profile of 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid
Property Insights of 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid. Following Lipinski's Rule of Five, 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid has 3 hydrogen bond donor(s) and 6 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 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid?
The CAS number of 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid is 6954-05-8.
What is the molecular formula of 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid?
The molecular formula of 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid is C14H11BrN4O3.
What is the molecular weight of 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid?
The molecular weight of 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid is 362.00 g/mol.
Where can I buy 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid?
You can request a quote for 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(5-bromo-6-oxo-1H-pyridazin-4-yl)hydrazinylidene]-4-phenylbut-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.