(Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid
TL;DR: (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid (CAS 902017-63-4) is a chemical compound with molecular formula C19H20N2O4S2 and molecular weight 404.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5Z)-5-[(5-methoxy-1,2-dimethylindol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid
Also Known As: (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid, 4-[(5Z)-5-[(5-methoxy-1,2-dimethylindol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid, 4-{(5Z)-5-[(5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoic acid
| Molecular Formula | C19H20N2O4S2 |
|---|---|
| Molecular Weight | 404.09 g/mol |
| LogP | 3.56132 |
| Topological Polar Surface Area | 71.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.08646 |
| Heavy Atoms | 27 |
| Complexity | 977.7352 |
Chemical Identifiers
| CAS Number | 902017-63-4 |
|---|---|
| SMILES | CC1=C(C2=C(N1C)C=CC(=C2)OC)/C=C\3/C(=O)N(C(=S)S3)CCCC(=O)O |
Product Overview
(Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid (CAS 902017-63-4), with molecular formula C19H20N2O4S2 and molecular weight 404.09 g/mol. IUPAC: 4-[(5Z)-5-[(5-methoxy-1,2-dimethylindol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid.
Chemical Property Profile of (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid
Property Insights of (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid
The XLogP value of 3.56132 indicates that (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.77 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid. Following Lipinski's Rule of Five, (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid has 1 hydrogen bond donor(s) and 5 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 (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid?
The CAS number of (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid is 902017-63-4.
What is the molecular formula of (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid?
The molecular formula of (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid is C19H20N2O4S2.
What is the molecular weight of (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid?
The molecular weight of (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid is 404.09 g/mol.
Where can I buy (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid?
You can request a quote for (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-(5-((5-methoxy-1,2-dimethyl-1H-indol-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.