![3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid structure](/static/products/4888/488823-77-4.webp)
3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid
TL;DR: 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid (CAS 488823-77-4) is a chemical compound with molecular formula C11H9NO4S and molecular weight 251.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2,4-dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid
Also Known As: 3-[(2,4-dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid, BAS 04880101, 3-((2,4-dioxothiazolidin-3-yl)methyl)benzoic acid, AP-893/40872482, 3-(2,4-Dioxo-thiazolidin-3-ylmethyl)-benzoic acid
| Molecular Formula | C11H9NO4S |
|---|---|
| Molecular Weight | 251.03 g/mol |
| LogP | 1.5802 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.02522 |
| Heavy Atoms | 17 |
| Complexity | 483.99973 |
Chemical Identifiers
| CAS Number | 488823-77-4 |
|---|---|
| SMILES | C1C(=O)N(C(=O)S1)CC2=CC(=CC=C2)C(=O)O |
Product Overview
3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid (CAS 488823-77-4), with molecular formula C11H9NO4S and molecular weight 251.03 g/mol. IUPAC: 3-[(2,4-dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid.
Chemical Property Profile of 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid
Property Insights of 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid
The XLogP value of 1.5802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid. Following Lipinski's Rule of Five, 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic 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 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid?
The CAS number of 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid is 488823-77-4.
What is the molecular formula of 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid?
The molecular formula of 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid is C11H9NO4S.
What is the molecular weight of 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid?
The molecular weight of 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid is 251.03 g/mol.
Where can I buy 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid?
You can request a quote for 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2,4-Dioxo-1,3-thiazolidin-3-yl)methyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.