![2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid structure](/static/products/6535/653588-49-9.webp)
2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid
TL;DR: 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid (CAS 653588-49-9) is a chemical compound with molecular formula C12H11NO4S2 and molecular weight 297.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid
Also Known As: 2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid, Acetic acid, [[4-(2-methyl-4-thiazolyl)phenyl]sulfonyl]-, 2-[4-(2-methylthiazol-4-yl)phenyl]sulfonylacetic acid, Acetic acid,[[4-(2-methyl-4-thiazolyl)phenyl]sulfonyl], [4-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-acetic acid
| Molecular Formula | C12H11NO4S2 |
|---|---|
| Molecular Weight | 297.01 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.01294 |
| Heavy Atoms | 19 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 653588-49-9 |
|---|---|
| SMILES | CC1=NC(=CS1)C2=CC=C(C=C2)S(=O)(=O)CC(=O)O |
| InChIKey | HWNQACFIPKXGDV-UHFFFAOYSA-N |
Product Overview
2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid (CAS 653588-49-9), with molecular formula C12H11NO4S2 and molecular weight 297.01 g/mol. IUPAC: 2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid.
Chemical Property Profile of 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid
Property Insights of 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid. Following Lipinski's Rule of Five, 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid has 1 hydrogen bond donor(s) and 6 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-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid?
The CAS number of 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid is 653588-49-9.
What is the molecular formula of 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid?
The molecular formula of 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid is C12H11NO4S2.
What is the molecular weight of 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid?
The molecular weight of 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid is 297.01 g/mol.
Where can I buy 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid?
You can request a quote for 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic 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-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(2-Methyl-1,3-thiazol-4-yl)phenyl]sulfonylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.