1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid
TL;DR: 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid (CAS 339096-33-2) is a chemical compound with molecular formula C14H13FN2O3S and molecular weight 308.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-6-oxo-4-propylsulfanylpyridazine-3-carboxylic acid
Also Known As: 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid, 8G-429S, 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydropyridazine-3-carboxylic acid, 1-(4-fluorophenyl)-6-oxo-4-propylsulfanylpyridazine-3-carboxylic acid, 1-(4-fluorophenyl)-6-oxo-4-propylsulfanyl-pyridazine-3-carboxylic Acid
| Molecular Formula | C14H13FN2O3S |
|---|---|
| Molecular Weight | 308.06 g/mol |
| LogP | 2.5719 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.06308 |
| Heavy Atoms | 21 |
| Complexity | 713.14935 |
Chemical Identifiers
| CAS Number | 339096-33-2 |
|---|---|
| SMILES | CCCSC1=CC(=O)N(N=C1C(=O)O)C2=CC=C(C=C2)F |
Product Overview
1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid (CAS 339096-33-2), with molecular formula C14H13FN2O3S and molecular weight 308.06 g/mol. IUPAC: 1-(4-fluorophenyl)-6-oxo-4-propylsulfanylpyridazine-3-carboxylic acid.
Chemical Property Profile of 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid
Property Insights of 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid
The XLogP value of 2.5719 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid. Following Lipinski's Rule of Five, 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid 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 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid?
The CAS number of 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid is 339096-33-2.
What is the molecular formula of 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid?
The molecular formula of 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid is C14H13FN2O3S.
What is the molecular weight of 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid?
The molecular weight of 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid is 308.06 g/mol.
Where can I buy 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid?
You can request a quote for 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.