![2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate structure](/static/products/6902/690222-01-6.webp)
2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate
TL;DR: 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate (CAS 690222-01-6) is a chemical compound with molecular formula C22H17BrO6S and molecular weight 487.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] 4-bromobenzoate
Also Known As: 2-(4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate, 2-[4-[[(4-Methylphenyl)sulfonyl]oxy]phenyl]-2-oxoethyl 4-bromobenzoate, [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] 4-bromobenzoate, 2-{4-[(4-Methylbenzene-1-sulfonyl)oxy]phenyl}-2-oxoethyl 4-bromobenzoate, 2-{4-[(4-methylphenyl)sulfonyloxy]phenyl}-2-oxoethyl 4-bromobenzoate
| Molecular Formula | C22H17BrO6S |
|---|---|
| Molecular Weight | 487.99 g/mol |
| LogP | 4.56492 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 487.99292 |
| Heavy Atoms | 30 |
| Complexity | 1151.7594 |
Chemical Identifiers
| CAS Number | 690222-01-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)COC(=O)C3=CC=C(C=C3)Br |
Product Overview
2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate (CAS 690222-01-6), with molecular formula C22H17BrO6S and molecular weight 487.99 g/mol. IUPAC: [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] 4-bromobenzoate.
Chemical Property Profile of 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate
Property Insights of 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate
The XLogP value of 4.56492 indicates that 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate. Following Lipinski's Rule of Five, 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate has 0 hydrogen bond donor(s) and 6 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 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate?
The CAS number of 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate is 690222-01-6.
What is the molecular formula of 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate?
The molecular formula of 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate is C22H17BrO6S.
What is the molecular weight of 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate?
The molecular weight of 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate is 487.99 g/mol.
Where can I buy 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate?
You can request a quote for 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-{[(4-Methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethyl 4-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.