![1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene structure](/static/products/848/848-17-9.png)
1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene
TL;DR: 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene (CAS 848-17-9) is a chemical compound with molecular formula C16H15F3O2S and molecular weight 328.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-trimethyl-2-[4-(trifluoromethyl)phenyl]sulfonylbenzene
Also Known As: 1,3,5-trimethyl-2-[4-(trifluoromethyl)phenyl]sulfonylbenzene, 1,3,5-trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene, 1,3,5-Trimethyl-2-[4-(trifluoromethyl)benzene-1-sulfonyl]benzene, 4-(trifluoromethyl)-1-[(2,4,6-trimethylphenyl)sulfonyl]benzene, 1,3,5-TRIMETHYL-2-[4-(TRIFLUOROMETHYL)BENZENESULFONYL]BENZENE
| Molecular Formula | C16H15F3O2S |
|---|---|
| Molecular Weight | 328.07 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.0745 |
| Heavy Atoms | 22 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 848-17-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)S(=O)(=O)C2=CC=C(C=C2)C(F)(F)F)C |
| InChIKey | JGCYZXZVFHIHNV-UHFFFAOYSA-N |
Product Overview
1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene (CAS 848-17-9), with molecular formula C16H15F3O2S and molecular weight 328.07 g/mol. IUPAC: 1,3,5-trimethyl-2-[4-(trifluoromethyl)phenyl]sulfonylbenzene.
Chemical Property Profile of 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene
Property Insights of 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene
The XLogP value of 4.6 indicates that 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene 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 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene?
The CAS number of 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene is 848-17-9.
What is the molecular formula of 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene?
The molecular formula of 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene is C16H15F3O2S.
What is the molecular weight of 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene?
The molecular weight of 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene is 328.07 g/mol.
Where can I buy 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene?
You can request a quote for 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Trimethyl-2-{[4-(trifluoromethyl)phenyl]sulfonyl}benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.