ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate
TL;DR: ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate (CAS 339096-26-3) is a chemical compound with molecular formula C16H17FN2O3S and molecular weight 336.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(4-fluorophenyl)-6-oxo-4-propylsulfanylpyridazine-3-carboxylate
Also Known As: ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate, ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydropyridazine-3-carboxylate, Ethyl 1-(4-fluorophenyl)-6-oxo-4-propylsulfanyl-pyridazine-3-carboxylate, ethyl 1-(4-fluorophenyl)-6-oxo-4-propylsulfanylpyridazine-3-carboxylate, ethyl1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydropyridazine-3-carboxylate
| Molecular Formula | C16H17FN2O3S |
|---|---|
| Molecular Weight | 336.09 g/mol |
| LogP | 3.0504 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.0944 |
| Heavy Atoms | 23 |
| Complexity | 743.98083 |
Chemical Identifiers
| CAS Number | 339096-26-3 |
|---|---|
| SMILES | CCCSC1=CC(=O)N(N=C1C(=O)OCC)C2=CC=C(C=C2)F |
Product Overview
ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate (CAS 339096-26-3), with molecular formula C16H17FN2O3S and molecular weight 336.09 g/mol. IUPAC: ethyl 1-(4-fluorophenyl)-6-oxo-4-propylsulfanylpyridazine-3-carboxylate.
Chemical Property Profile of ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate
Property Insights of ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate
The XLogP value of 3.0504 indicates that ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate. Following Lipinski's Rule of Five, ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate has 0 hydrogen bond donor(s) and 5 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 ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate?
The CAS number of ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate is 339096-26-3.
What is the molecular formula of ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate?
The molecular formula of ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate is C16H17FN2O3S.
What is the molecular weight of ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate?
The molecular weight of ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate is 336.09 g/mol.
Where can I buy ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate?
You can request a quote for ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1-(4-fluorophenyl)-6-oxo-4-(propylsulfanyl)-1,6-dihydro-3-pyridazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.