![4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one structure](/static/products/340/340696-30-2.png)
4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one
TL;DR: 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one (CAS 340696-30-2) is a chemical compound with molecular formula C26H25NO3S and molecular weight 431.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(4-methylphenyl)-1-(4-methylphenyl)sulfonylindol-2-yl]butan-2-one
Also Known As: J1.487.704E, 4-(3-(p-tolyl)-1-tosyl-1H-indol-2-yl)butan-2-one, 4-[1-Tosyl-3-(4-methylphenyl)-1H-indole-2-yl]-2-butanone, 4-[3-(4-methylphenyl)-1-(4-methylphenyl)sulfonylindol-2-yl]butan-2-one, 4-[1-(4-methylbenzenesulfonyl)-3-(4-methylphenyl)-1H-indol-2-yl]butan-2-one
| Molecular Formula | C26H25NO3S |
|---|---|
| Molecular Weight | 431.16 g/mol |
| LogP | 5.68374 |
| Topological Polar Surface Area | 56.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.15552 |
| Heavy Atoms | 31 |
| Complexity | 1362.9519 |
Chemical Identifiers
| CAS Number | 340696-30-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=C(N(C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C)CCC(=O)C |
Product Overview
4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one (CAS 340696-30-2), with molecular formula C26H25NO3S and molecular weight 431.16 g/mol. IUPAC: 4-[3-(4-methylphenyl)-1-(4-methylphenyl)sulfonylindol-2-yl]butan-2-one.
Chemical Property Profile of 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one
Property Insights of 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one
The XLogP value of 5.68374 indicates that 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.14 Ų, 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one?
The CAS number of 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one is 340696-30-2.
What is the molecular formula of 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one?
The molecular formula of 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one is C26H25NO3S.
What is the molecular weight of 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one?
The molecular weight of 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one is 431.16 g/mol.
Where can I buy 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one?
You can request a quote for 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-{3-(4-methylphenyl)-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.