![[3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate structure](/static/products/6556/65562-34-7.webp)
[3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate
TL;DR: [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate (CAS 65562-34-7) is a chemical compound with molecular formula C22H22BrNO10S3 and molecular weight 634.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate
Also Known As: [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate|(5Z)-5-[(5-Bromothiophen-2-yl)methylidene]-2-sulfanylidene-3-(2,3,4,6-tetra-O-acetylhexopyranosyl)-1,3-thiazolidin-4-one
| Molecular Formula | C22H22BrNO10S3 |
|---|---|
| Molecular Weight | 634.96 g/mol |
| LogP | 2.7949 |
| Topological Polar Surface Area | 134.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 634.9589 |
| Heavy Atoms | 37 |
| Complexity | 1151.4856 |
Chemical Identifiers
| CAS Number | 65562-34-7 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)N2C(=O)/C(=C/C3=CC=C(S3)Br)/SC2=S)OC(=O)C)OC(=O)C)OC(=O)C |
Product Overview
[3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate (CAS 65562-34-7), with molecular formula C22H22BrNO10S3 and molecular weight 634.96 g/mol. IUPAC: [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate.
Chemical Property Profile of [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate
Property Insights of [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate
The XLogP value of 2.7949 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate. The TPSA of 134.74 Ų falls within the moderate polarity range, balancing permeability and solubility for [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate. Following Lipinski's Rule of Five, [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate has 0 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate?
The CAS number of [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate is 65562-34-7.
What is the molecular formula of [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate?
The molecular formula of [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate is C22H22BrNO10S3.
What is the molecular weight of [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate?
The molecular weight of [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate is 634.96 g/mol.
Where can I buy [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate?
You can request a quote for [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for [3,4,5-triacetyloxy-6-[(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]oxan-2-yl]methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.