5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one
TL;DR: 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one (CAS 330559-07-4) is a chemical compound with molecular formula C27H21NO4S2 and molecular weight 487.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one, (5e)-5-{[2-(3,4-dimethoxyphenyl)-4-phenyl-4h-chromen-3-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one, 5-[[2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C27H21NO4S2 |
|---|---|
| Molecular Weight | 487.09 g/mol |
| LogP | 5.6712 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 487.0912 |
| Heavy Atoms | 34 |
| Complexity | 1347.7458 |
Chemical Identifiers
| CAS Number | 330559-07-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=C(C(C3=CC=CC=C3O2)C4=CC=CC=C4)C=C5C(=O)NC(=S)S5)OC |
Product Overview
5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one (CAS 330559-07-4), with molecular formula C27H21NO4S2 and molecular weight 487.09 g/mol. IUPAC: 5-[[2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one
Property Insights of 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one
The XLogP value of 5.6712 indicates that 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-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 56.79 Ų, 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-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, 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one 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 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
The CAS number of 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is 330559-07-4.
What is the molecular formula of 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
The molecular formula of 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is C27H21NO4S2.
What is the molecular weight of 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
The molecular weight of 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one is 487.09 g/mol.
Where can I buy 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
You can request a quote for 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-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 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-((2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl)methylene)-2-thioxothiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.