![1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone structure](/static/products/6945/694507-90-9.webp)
1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone
TL;DR: 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone (CAS 694507-90-9) 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.
1-(2,5-dimethylphenyl)-2-(4-methylphenyl)sulfonylethanone
Also Known As: 1-(2,5-dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone, 1-(2,5-dimethylphenyl)-2-(4-methylphenyl)sulfonylethanone, AP-853/42161445, 1-(2,5-DIMETHYLPHENYL)-2-(4-METHYLBENZENESULFONYL)ETHANONE
| Molecular Formula | C17H18O3S |
|---|---|
| Molecular Weight | 302.10 g/mol |
| LogP | 3.26846 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.09766 |
| Heavy Atoms | 21 |
| Complexity | 772.18256 |
Chemical Identifiers
| CAS Number | 694507-90-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)CC(=O)C2=C(C=CC(=C2)C)C |
Product Overview
1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone (CAS 694507-90-9), with molecular formula C17H18O3S and molecular weight 302.10 g/mol. IUPAC: 1-(2,5-dimethylphenyl)-2-(4-methylphenyl)sulfonylethanone.
Chemical Property Profile of 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone
Property Insights of 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone
The XLogP value of 3.26846 indicates that 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.21 Ų, 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone 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 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone?
The CAS number of 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone is 694507-90-9.
What is the molecular formula of 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone?
The molecular formula of 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone is C17H18O3S.
What is the molecular weight of 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone?
The molecular weight of 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone is 302.10 g/mol.
Where can I buy 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone?
You can request a quote for 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,5-Dimethylphenyl)-2-[(4-methylphenyl)sulfonyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.