2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid
TL;DR: 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid (CAS 20403-74-1) is a chemical compound with molecular formula C11H8ClNO3S and molecular weight 268.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3-chloro-4-hydroxyphenyl)-1,3-thiazol-4-yl]acetic acid
Also Known As: 2-(3-chloro-4-hydroxyphenyl)-4-thiazoleacetic acid, 2-(3'-Chloro-4'-hydroxyphenyl)thiazole-4-acetic acid, 4-Thiazoleacetic acid, 2-(3-chloro-4-hydroxyphenyl)-, 2-(Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid, [2-(3-Chloro-4-hydroxyphenyl)-1,3-thiazol-4-yl]acetic acid #
| Molecular Formula | C11H8ClNO3S |
|---|---|
| Molecular Weight | 268.99 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.99133 |
| Heavy Atoms | 17 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 20403-74-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2=NC(=CS2)CC(=O)O)Cl)O |
| InChIKey | PKOZULYPLMNNKN-UHFFFAOYSA-N |
Product Overview
2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid (CAS 20403-74-1), with molecular formula C11H8ClNO3S and molecular weight 268.99 g/mol. IUPAC: 2-[2-(3-chloro-4-hydroxyphenyl)-1,3-thiazol-4-yl]acetic acid.
Chemical Property Profile of 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid
Property Insights of 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid. Following Lipinski's Rule of Five, 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid has 2 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-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid?
The CAS number of 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid is 20403-74-1.
What is the molecular formula of 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid?
The molecular formula of 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid is C11H8ClNO3S.
What is the molecular weight of 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid?
The molecular weight of 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid is 268.99 g/mol.
Where can I buy 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid?
You can request a quote for 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Chloro-4-hydroxyphenyl)-4-thiazoleacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.