(Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid
TL;DR: (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid (CAS 497247-64-0) is a chemical compound with molecular formula C28H22N2O5S2 and molecular weight 530.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5Z)-5-[[1-[2-(4-methoxyphenoxy)ethyl]indol-3-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid
Also Known As: (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid, 3-[(5Z)-5-({1-[2-(4-methoxyphenoxy)ethyl]-1H-indol-3-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoic acid, 3-[(5Z)-5-[[1-[2-(4-methoxyphenoxy)ethyl]indol-3-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid
| Molecular Formula | C28H22N2O5S2 |
|---|---|
| Molecular Weight | 530.10 g/mol |
| LogP | 5.8329 |
| Topological Polar Surface Area | 81.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 530.097 |
| Heavy Atoms | 37 |
| Complexity | 1541.9761 |
Chemical Identifiers
| CAS Number | 497247-64-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OCCN2C=C(C3=CC=CC=C32)/C=C\4/C(=O)N(C(=S)S4)C5=CC=CC(=C5)C(=O)O |
Product Overview
(Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid (CAS 497247-64-0), with molecular formula C28H22N2O5S2 and molecular weight 530.10 g/mol. IUPAC: 3-[(5Z)-5-[[1-[2-(4-methoxyphenoxy)ethyl]indol-3-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid.
Chemical Property Profile of (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid
Property Insights of (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid
The XLogP value of 5.8329 indicates that (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid. Following Lipinski's Rule of Five, (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic 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 (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid?
The CAS number of (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid is 497247-64-0.
What is the molecular formula of (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid?
The molecular formula of (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid is C28H22N2O5S2.
What is the molecular weight of (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid?
The molecular weight of (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid is 530.10 g/mol.
Where can I buy (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid?
You can request a quote for (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(5-((1-(2-(4-methoxyphenoxy)ethyl)-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.