4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid
TL;DR: 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid (CAS 871544-52-4) is a chemical compound with molecular formula C9H7NO2S2 and molecular weight 224.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxylic acid
Also Known As: 4-methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid, 4-methyl-2-thien-3-yl-1,3-thiazole-5-carboxylic acid, 4-methyl-2-(3-thienyl)thiazole-5-carboxylic acid, 4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxylic Acid, AB00742952-01
| Molecular Formula | C9H7NO2S2 |
|---|---|
| Molecular Weight | 224.99 g/mol |
| LogP | 2.87822 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.99182 |
| Heavy Atoms | 14 |
| Complexity | 459.12027 |
Chemical Identifiers
| CAS Number | 871544-52-4 |
|---|---|
| SMILES | CC1=C(SC(=N1)C2=CSC=C2)C(=O)O |
Product Overview
4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid (CAS 871544-52-4), with molecular formula C9H7NO2S2 and molecular weight 224.99 g/mol. IUPAC: 4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxylic acid.
Chemical Property Profile of 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid
Property Insights of 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid
The XLogP value of 2.87822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid. With a topological polar surface area (TPSA) of 50.19 Ų, 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic 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-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid?
The CAS number of 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid is 871544-52-4.
What is the molecular formula of 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid?
The molecular formula of 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid is C9H7NO2S2.
What is the molecular weight of 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid?
The molecular weight of 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid is 224.99 g/mol.
Where can I buy 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid?
You can request a quote for 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-2-(thiophen-3-yl)-1,3-thiazole-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.