(Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one
TL;DR: (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one (CAS 899386-53-9) is a chemical compound with molecular formula C21H15NO4S2 and molecular weight 409.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-benzyl-5-[(6-methoxy-4-oxochromen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one, (5Z)-3-benzyl-5-[(6-methoxy-4-oxo-4H-chromen-3-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one, (5Z)-3-benzyl-5-[(6-methoxy-4-oxochromen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C21H15NO4S2 |
|---|---|
| Molecular Weight | 409.04 g/mol |
| LogP | 4.203 |
| Topological Polar Surface Area | 59.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.04425 |
| Heavy Atoms | 28 |
| Complexity | 1167.9891 |
Chemical Identifiers
| CAS Number | 899386-53-9 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)OC=C(C2=O)/C=C\3/C(=O)N(C(=S)S3)CC4=CC=CC=C4 |
Product Overview
(Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one (CAS 899386-53-9), with molecular formula C21H15NO4S2 and molecular weight 409.04 g/mol. IUPAC: (5Z)-3-benzyl-5-[(6-methoxy-4-oxochromen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one
Property Insights of (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one
The XLogP value of 4.203 indicates that (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.75 Ų, (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one has 0 hydrogen bond donor(s) and 6 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)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
The CAS number of (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is 899386-53-9.
What is the molecular formula of (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
The molecular formula of (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is C21H15NO4S2.
What is the molecular weight of (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
The molecular weight of (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is 409.04 g/mol.
Where can I buy (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
You can request a quote for (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-benzyl-5-((6-methoxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.