3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
TL;DR: 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 5566-41-6) is a chemical compound with molecular formula C15H15NO3S2 and molecular weight 321.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(3,5-dimethoxyphenyl)methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BIM-0024835.P001, 3-allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one, AB00089515-01, (5E)-5-[(3,5-dimethoxyphenyl)methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one, (5E)-5-[(3,5-DIMETHOXYPHENYL)METHYLIDENE]-3-(PROP-2-EN-1-YL)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE
| Molecular Formula | C15H15NO3S2 |
|---|---|
| Molecular Weight | 321.05 g/mol |
| LogP | 3.091 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 321.04935 |
| Heavy Atoms | 21 |
| Complexity | 603.0948 |
Chemical Identifiers
| CAS Number | 5566-41-6 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)CC=C)OC |
Product Overview
3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 5566-41-6), with molecular formula C15H15NO3S2 and molecular weight 321.05 g/mol. IUPAC: (5E)-5-[(3,5-dimethoxyphenyl)methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Property Insights of 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
The XLogP value of 3.091 indicates that 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one has 0 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 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The CAS number of 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 5566-41-6.
What is the molecular formula of 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular formula of 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is C15H15NO3S2.
What is the molecular weight of 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular weight of 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 321.05 g/mol.
Where can I buy 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
You can request a quote for 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Allyl-5-(3,5-dimethoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.