![2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid structure](/static/products/1611/161192-54-7.webp)
2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid
TL;DR: 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid (CAS 161192-54-7) is a chemical compound with molecular formula C26H21NO5S2 and molecular weight 491.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[[3,4-bis(phenylmethoxy)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Also Known As: 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid, 5-[[3,4-bis(phenylmethoxy)phenyl]methylene]-4-oxo-2-thioxo-3-thiazolidineacetic Acid
| Molecular Formula | C26H21NO5S2 |
|---|---|
| Molecular Weight | 491.09 g/mol |
| LogP | 5.1304 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 491.08612 |
| Heavy Atoms | 34 |
| Complexity | 1228.4531 |
Chemical Identifiers
| CAS Number | 161192-54-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)CC(=O)O)OCC4=CC=CC=C4 |
Product Overview
2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid (CAS 161192-54-7), with molecular formula C26H21NO5S2 and molecular weight 491.09 g/mol. IUPAC: 2-[5-[[3,4-bis(phenylmethoxy)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid.
Chemical Property Profile of 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid
Property Insights of 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid
The XLogP value of 5.1304 indicates that 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid. Following Lipinski's Rule of Five, 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid?
The CAS number of 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid is 161192-54-7.
What is the molecular formula of 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid?
The molecular formula of 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid is C26H21NO5S2.
What is the molecular weight of 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid?
The molecular weight of 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid is 491.09 g/mol.
Where can I buy 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid?
You can request a quote for 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-[3,4-Bis(benzyloxy)benzylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.