![4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid structure](/static/products/432/432001-10-0.png)
4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid
TL;DR: 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid (CAS 432001-10-0) is a chemical compound with molecular formula C14H9NO4S and molecular weight 287.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic acid
Also Known As: AB00117284-01, 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid, (E)-4-((2,4-dioxo-3-(prop-2-yn-1-yl)thiazolidin-5-ylidene)methyl)benzoic acid, 4-[(E)-(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic acid, 4-{(E)-[2,4-dioxo-3-(prop-2-yn-1-yl)-1,3-thiazolidin-5-ylidene]methyl}benzoic acid
| Molecular Formula | C14H9NO4S |
|---|---|
| Molecular Weight | 287.03 g/mol |
| LogP | 2.0543 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.02524 |
| Heavy Atoms | 20 |
| Complexity | 654.74664 |
Chemical Identifiers
| CAS Number | 432001-10-0 |
|---|---|
| SMILES | C#CCN1C(=O)/C(=C\C2=CC=C(C=C2)C(=O)O)/SC1=O |
Product Overview
4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid (CAS 432001-10-0), with molecular formula C14H9NO4S and molecular weight 287.03 g/mol. IUPAC: 4-[(E)-(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic acid.
Chemical Property Profile of 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid
Property Insights of 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid
The XLogP value of 2.0543 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid. Following Lipinski's Rule of Five, 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)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 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid?
The CAS number of 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid is 432001-10-0.
What is the molecular formula of 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid?
The molecular formula of 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid is C14H9NO4S.
What is the molecular weight of 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid?
The molecular weight of 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid is 287.03 g/mol.
Where can I buy 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid?
You can request a quote for 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)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 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.