(5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
TL;DR: (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 1103516-25-1) is a chemical compound with molecular formula C19H15NO2S2 and molecular weight 353.0544 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5E)-5-[(3-phenoxyphenyl)methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00277086, 3-Allyl-5-(3-phenoxy-benzylidene)-2-thioxo-thiazolidin-4-one, 3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (5E)-5-(3-phenoxybenzylidene)-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Technical Specifications
| Molecular Formula | C19H15NO2S2 |
| Molecular Weight | 353.0544 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 86.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.0544 Da |
| Heavy Atoms | 24 |
| Complexity | 525.0 |
| SMILES | C=CCN1C(=O)/C(=C\C2=CC(=CC=C2)OC3=CC=CC=C3)/SC1=S |
| InChIKey | UBOCSQNBSIPXHK-GHRIWEEISA-N |
Chemical Property Profile of (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Property Insights of (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
The XLogP value of 5.2 indicates that (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The CAS number of (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 1103516-25-1.
What is the molecular formula of (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular formula of (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is C19H15NO2S2.
What is the molecular weight of (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular weight of (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 353.0544 g/mol.
Where can I buy (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
You can request a quote for (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
Yes, CoreyChem provides custom synthesis services for (5E)-3-allyl-5-(3-phenoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.