(5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one
TL;DR: (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 429653-93-0) is a chemical compound with molecular formula C18H15NO2S2 and molecular weight 341.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-benzyl-5-[(2-hydroxy-5-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (5E)-3-benzyl-5-[(2-hydroxy-5-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C18H15NO2S2 |
|---|---|
| Molecular Weight | 341.05 g/mol |
| LogP | 4.10202 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.0544 |
| Heavy Atoms | 23 |
| Complexity | 799.9238 |
Chemical Identifiers
| CAS Number | 429653-93-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)O)/C=C/2\C(=O)N(C(=S)S2)CC3=CC=CC=C3 |
Product Overview
(5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one (CAS 429653-93-0), with molecular formula C18H15NO2S2 and molecular weight 341.05 g/mol. IUPAC: (5E)-3-benzyl-5-[(2-hydroxy-5-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Property Insights of (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one
The XLogP value of 4.10202 indicates that (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-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 40.54 Ų, (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one has 1 hydrogen bond donor(s) and 4 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 (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The CAS number of (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 429653-93-0.
What is the molecular formula of (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular formula of (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one is C18H15NO2S2.
What is the molecular weight of (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
The molecular weight of (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one is 341.05 g/mol.
Where can I buy (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
You can request a quote for (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-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 (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5E)-3-benzyl-5-(2-hydroxy-5-methylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.