![6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile structure](/static/products/338/338417-89-3.png)
6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile
TL;DR: 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile (CAS 338417-89-3) is a chemical compound with molecular formula C18H10F3N3S and molecular weight 357.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-phenyl-3-[3-(trifluoromethyl)phenyl]sulfanylpyridazine-4-carbonitrile
Also Known As: Bionet1_002362, 4D-100, 6-phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile, 6-phenyl-3-[3-(trifluoromethyl)phenyl]sulfanylpyridazine-4-carbonitrile, 6-phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}pyridazine-4-carbonitrile
| Molecular Formula | C18H10F3N3S |
|---|---|
| Molecular Weight | 357.05 g/mol |
| LogP | 5.18528 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.05475 |
| Heavy Atoms | 25 |
| Complexity | 934.2866 |
Chemical Identifiers
| CAS Number | 338417-89-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=C(C(=C2)C#N)SC3=CC=CC(=C3)C(F)(F)F |
Product Overview
6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile (CAS 338417-89-3), with molecular formula C18H10F3N3S and molecular weight 357.05 g/mol. IUPAC: 6-phenyl-3-[3-(trifluoromethyl)phenyl]sulfanylpyridazine-4-carbonitrile.
Chemical Property Profile of 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile
Property Insights of 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile
The XLogP value of 5.18528 indicates that 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.57 Ų, 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile?
The CAS number of 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile is 338417-89-3.
What is the molecular formula of 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile?
The molecular formula of 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile is C18H10F3N3S.
What is the molecular weight of 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile?
The molecular weight of 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile is 357.05 g/mol.
Where can I buy 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile?
You can request a quote for 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Phenyl-3-{[3-(trifluoromethyl)phenyl]sulfanyl}-4-pyridazinecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.