4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone
TL;DR: 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone (CAS 33866-93-2) is a chemical compound with molecular formula C17H18O3S and molecular weight 302.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylphenyl)sulfonyl-4-phenylbutan-2-one
Also Known As: BAS 01215582, 4-Phenyl-4-(toluene-4-sulfonyl)-butan-2-one, 4-((4-METHYLPHENYL)SULFONYL)-4-PHENYL-2-BUTANONE, J3.290.229D, Methyl(beta-(p-tolylsulfonyl)phenethyl) ketone
| Molecular Formula | C17H18O3S |
|---|---|
| Molecular Weight | 302.10 g/mol |
| LogP | 3.48912 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 302.09766 |
| Heavy Atoms | 21 |
| Complexity | 716.3904 |
Chemical Identifiers
| CAS Number | 33866-93-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(CC(=O)C)C2=CC=CC=C2 |
Product Overview
4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone (CAS 33866-93-2), with molecular formula C17H18O3S and molecular weight 302.10 g/mol. IUPAC: 4-(4-methylphenyl)sulfonyl-4-phenylbutan-2-one.
Chemical Property Profile of 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone
Property Insights of 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone
The XLogP value of 3.48912 indicates that 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.21 Ų, 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone 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 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone?
The CAS number of 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone is 33866-93-2.
What is the molecular formula of 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone?
The molecular formula of 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone is C17H18O3S.
What is the molecular weight of 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone?
The molecular weight of 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone is 302.10 g/mol.
Where can I buy 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone?
You can request a quote for 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-Methylphenyl)sulfonyl)-4-phenyl-2-butanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.