![[5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid structure](/static/products/5558/5558-77-0.webp)
[5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
TL;DR: [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid (CAS 5558-77-0) is a chemical compound with molecular formula C16H11NO3S2 and molecular weight 329.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5E)-5-(naphthalen-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Also Known As: BAS 00459500, J1.041.896H, AB00089111-01, [5-(2-naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid, 2-Thioxo-4-oxo-5-(2-naphthylmethylene)-3-thiazolidineacetic acid
| Molecular Formula | C16H11NO3S2 |
|---|---|
| Molecular Weight | 329.02 g/mol |
| LogP | 3.1256 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.01804 |
| Heavy Atoms | 22 |
| Complexity | 829.0057 |
Chemical Identifiers
| CAS Number | 5558-77-0 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)/C=C/3\C(=O)N(C(=S)S3)CC(=O)O |
Product Overview
[5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid (CAS 5558-77-0), with molecular formula C16H11NO3S2 and molecular weight 329.02 g/mol. IUPAC: 2-[(5E)-5-(naphthalen-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid.
Chemical Property Profile of [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Property Insights of [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
The XLogP value of 3.1256 indicates that [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid 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 [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid?
The CAS number of [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid is 5558-77-0.
What is the molecular formula of [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid?
The molecular formula of [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid is C16H11NO3S2.
What is the molecular weight of [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid?
The molecular weight of [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid is 329.02 g/mol.
Where can I buy [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid?
You can request a quote for [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [5-(2-Naphthylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.