![2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid structure](/static/products/5688/5688-68-6.webp)
2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
TL;DR: 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid (CAS 5688-68-6) is a chemical compound with molecular formula C18H14N2O3S2 and molecular weight 370.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-oxo-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid
Also Known As: 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid, 2-[4-oxo-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenyl-propanoic Acid, 2-[4-oxo-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid
| Molecular Formula | C18H14N2O3S2 |
|---|---|
| Molecular Weight | 370.04 g/mol |
| LogP | 2.9787 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.0446 |
| Heavy Atoms | 25 |
| Complexity | 837.91437 |
Chemical Identifiers
| CAS Number | 5688-68-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C(=CC3=CN=CC=C3)SC2=S |
Product Overview
2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid (CAS 5688-68-6), with molecular formula C18H14N2O3S2 and molecular weight 370.04 g/mol. IUPAC: 2-[4-oxo-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid.
Chemical Property Profile of 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
Property Insights of 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
The XLogP value of 2.9787 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid. Following Lipinski's Rule of Five, 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid has 1 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 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid?
The CAS number of 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid is 5688-68-6.
What is the molecular formula of 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid?
The molecular formula of 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid is C18H14N2O3S2.
What is the molecular weight of 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid?
The molecular weight of 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid is 370.04 g/mol.
Where can I buy 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid?
You can request a quote for 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{4-Oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.