![[5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate structure](/static/products/6635/6635-78-5.webp)
[5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate
TL;DR: [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate (CAS 6635-78-5) is a chemical compound with molecular formula C20H26O9S2 and molecular weight 474.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate
Also Known As: [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate|3-O-Acetyl-6-S-acetyl-5-O-(4-methylbenzene-1-sulfonyl)-1,2-O-(1-methylethylidene)-6-thiohexofuranose
| Molecular Formula | C20H26O9S2 |
|---|---|
| Molecular Weight | 474.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 474.10184 |
| Heavy Atoms | 31 |
| Complexity | 768.0 |
Chemical Identifiers
| CAS Number | 6635-78-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC(CSC(=O)C)C2C(C3C(O2)OC(O3)(C)C)OC(=O)C |
| InChIKey | AGUFRLIBVFOQJG-UHFFFAOYSA-N |
Product Overview
[5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate (CAS 6635-78-5), with molecular formula C20H26O9S2 and molecular weight 474.10 g/mol. IUPAC: [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate.
Chemical Property Profile of [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate
Property Insights of [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate. The TPSA of 148.0 Ų indicates high polarity, suggesting [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate has 0 hydrogen bond donor(s) and 10 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 [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate?
The CAS number of [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate is 6635-78-5.
What is the molecular formula of [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate?
The molecular formula of [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate is C20H26O9S2.
What is the molecular weight of [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate?
The molecular weight of [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate is 474.10 g/mol.
Where can I buy [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate?
You can request a quote for [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [5-[2-acetylsulfanyl-1-(4-methylphenyl)sulfonyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.