(Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one
TL;DR: (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one (CAS 899390-46-6) is a chemical compound with molecular formula C20H13NO4S2 and molecular weight 395.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-benzyl-5-[(6-hydroxy-4-oxochromen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one, (5Z)-3-benzyl-5-[(6-hydroxy-4-oxo-4H-chromen-3-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one, (5Z)-3-benzyl-5-[(6-hydroxy-4-oxochromen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C20H13NO4S2 |
|---|---|
| Molecular Weight | 395.03 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 70.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.0286 |
| Heavy Atoms | 27 |
| Complexity | 1151.6055 |
Chemical Identifiers
| CAS Number | 899390-46-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)/C(=C/C3=COC4=C(C3=O)C=C(C=C4)O)/SC2=S |
Product Overview
(Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one (CAS 899390-46-6), with molecular formula C20H13NO4S2 and molecular weight 395.03 g/mol. IUPAC: (5Z)-3-benzyl-5-[(6-hydroxy-4-oxochromen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one
Property Insights of (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one
The XLogP value of 3.9 indicates that (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.75 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one. Following Lipinski's Rule of Five, (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one has 1 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-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
The CAS number of (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is 899390-46-6.
What is the molecular formula of (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
The molecular formula of (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is C20H13NO4S2.
What is the molecular weight of (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
The molecular weight of (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is 395.03 g/mol.
Where can I buy (Z)-3-benzyl-5-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
You can request a quote for (Z)-3-benzyl-5-((6-hydroxy-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-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-benzyl-5-((6-hydroxy-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.