1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate)
TL;DR: 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate) (CAS 294668-94-3) is a chemical compound with molecular formula C16H14Cl2O8S3 and molecular weight 499.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-chlorophenyl)sulfonyloxy-1,1-dioxothiolan-3-yl] 4-chlorobenzenesulfonate
Also Known As: BAS 03457557, 1,1-dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate), 1,1-dioxidotetrahydrothiene-3,4-diyl bis(4-chlorobenzenesulfonate), [4-(4-chlorophenyl)sulfonyloxy-1,1-dioxothiolan-3-yl] 4-chlorobenzenesulfonate
| Molecular Formula | C16H14Cl2O8S3 |
|---|---|
| Molecular Weight | 499.92 g/mol |
| LogP | 2.2698 |
| Topological Polar Surface Area | 120.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 499.9228 |
| Heavy Atoms | 29 |
| Complexity | 1114.4309 |
Chemical Identifiers
| CAS Number | 294668-94-3 |
|---|---|
| SMILES | C1C(C(CS1(=O)=O)OS(=O)(=O)C2=CC=C(C=C2)Cl)OS(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate) (CAS 294668-94-3), with molecular formula C16H14Cl2O8S3 and molecular weight 499.92 g/mol. IUPAC: [4-(4-chlorophenyl)sulfonyloxy-1,1-dioxothiolan-3-yl] 4-chlorobenzenesulfonate.
Chemical Property Profile of 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate)
Property Insights of 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate)
The XLogP value of 2.2698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate). The TPSA of 120.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate). Following Lipinski's Rule of Five, 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate) has 0 hydrogen bond donor(s) and 8 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 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate)?
The CAS number of 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate) is 294668-94-3.
What is the molecular formula of 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate)?
The molecular formula of 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate) is C16H14Cl2O8S3.
What is the molecular weight of 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate)?
The molecular weight of 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate) is 499.92 g/mol.
Where can I buy 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate)?
You can request a quote for 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate)?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dioxidotetrahydrothiophene-3,4-diyl bis(4-chlorobenzenesulfonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.