3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one
TL;DR: 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one (CAS 299904-10-2) is a chemical compound with molecular formula C17H13NO2S2 and molecular weight 327.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-benzyl-5-[(4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00032374, 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one, (5E)-3-benzyl-5-[(4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (5E)-3-benzyl-5-(4-hydroxybenzylidene)-2-thioxo-thiazolidin-4-one, (E)-3-benzyl-5-(4-hydroxybenzylidene)-2-thioxothiazolidin-4-one
| Molecular Formula | C17H13NO2S2 |
|---|---|
| Molecular Weight | 327.04 g/mol |
| LogP | 3.7936 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.03876 |
| Heavy Atoms | 22 |
| Complexity | 739.0141 |
Chemical Identifiers
| CAS Number | 299904-10-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)/C(=C\C3=CC=C(C=C3)O)/SC2=S |
Product Overview
3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one (CAS 299904-10-2), with molecular formula C17H13NO2S2 and molecular weight 327.04 g/mol. IUPAC: (5E)-3-benzyl-5-[(4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one
Property Insights of 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one
The XLogP value of 3.7936 indicates that 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-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, 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-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 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one?
The CAS number of 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one is 299904-10-2.
What is the molecular formula of 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one?
The molecular formula of 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one is C17H13NO2S2.
What is the molecular weight of 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one?
The molecular weight of 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one is 327.04 g/mol.
Where can I buy 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one?
You can request a quote for 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-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-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzyl-5-(4-hydroxy-benzylidene)-2-thioxo-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.