2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
TL;DR: 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid (CAS 436087-66-0) is a chemical compound with molecular formula C11H8FNO2S and molecular weight 237.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
Also Known As: 2-(4-Fluorophenyl)-4-methylthiazole-5-carboxylic acid, 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic Acid, 2-(4-fluorophenyl)-4-methyl-5-thiazolecarboxylic acid, 2-(4-fluorophenyl)-4-methyl-5-thiazolecarboxylicacid, 7085AA
| Molecular Formula | C11H8FNO2S |
|---|---|
| Molecular Weight | 237.03 g/mol |
| LogP | 2.95582 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.02597 |
| Heavy Atoms | 16 |
| Complexity | 533.4176 |
Chemical Identifiers
| CAS Number | 436087-66-0 |
|---|---|
| SMILES | CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)O |
Product Overview
2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid (CAS 436087-66-0), with molecular formula C11H8FNO2S and molecular weight 237.03 g/mol. IUPAC: 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid.
Chemical Property Profile of 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
Property Insights of 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
The XLogP value of 2.95582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid. With a topological polar surface area (TPSA) of 50.19 Ų, 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid has 1 hydrogen bond donor(s) and 3 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-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid?
The CAS number of 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid is 436087-66-0.
What is the molecular formula of 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid?
The molecular formula of 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid is C11H8FNO2S.
What is the molecular weight of 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid?
The molecular weight of 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid is 237.03 g/mol.
Where can I buy 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid?
You can request a quote for 2-(4-Fluorophenyl)-4-methyl-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 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.