3-((2-Fluorobenzyl)thio)-6-phenylpyridazine
TL;DR: 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine (CAS 872630-31-4) is a chemical compound with molecular formula C17H13FN2S and molecular weight 296.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-fluorophenyl)methylsulfanyl]-6-phenylpyridazine
Also Known As: 3-((2-fluorobenzyl)thio)-6-phenylpyridazine, 3-{[(2-fluorophenyl)methyl]sulfanyl}-6-phenylpyridazine, 3-[(2-fluorophenyl)methylsulfanyl]-6-phenylpyridazine, F1899-0006
| Molecular Formula | C17H13FN2S |
|---|---|
| Molecular Weight | 296.08 g/mol |
| LogP | 4.575 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.07834 |
| Heavy Atoms | 21 |
| Complexity | 714.3696 |
Chemical Identifiers
| CAS Number | 872630-31-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=C(C=C2)SCC3=CC=CC=C3F |
Product Overview
3-((2-Fluorobenzyl)thio)-6-phenylpyridazine (CAS 872630-31-4), with molecular formula C17H13FN2S and molecular weight 296.08 g/mol. IUPAC: 3-[(2-fluorophenyl)methylsulfanyl]-6-phenylpyridazine.
Chemical Property Profile of 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine
Property Insights of 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine
The XLogP value of 4.575 indicates that 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine has 0 hydrogen bond donor(s) and 3 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 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine?
The CAS number of 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine is 872630-31-4.
What is the molecular formula of 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine?
The molecular formula of 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine is C17H13FN2S.
What is the molecular weight of 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine?
The molecular weight of 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine is 296.08 g/mol.
Where can I buy 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine?
You can request a quote for 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine?
Yes, KEHONG BIO provides custom synthesis services for 3-((2-Fluorobenzyl)thio)-6-phenylpyridazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.