4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid
TL;DR: 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid (CAS 5305-59-9) is a chemical compound with molecular formula C6H8N2O2S and molecular weight 172.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid
Also Known As: 4-methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid, 6-chloropyrimidin-4-ylamine, 4-Methyl-2-(methylamino)thiazole-5-carboxylic acid, 4-Methyl-2-methylamino-thiazole-5-carboxylic acid, BAS 04916109
| Molecular Formula | C6H8N2O2S |
|---|---|
| Molecular Weight | 172.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 90.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.03065 |
| Heavy Atoms | 11 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 5305-59-9 |
|---|---|
| SMILES | CC1=C(SC(=N1)NC)C(=O)O |
| InChIKey | STAHVMUZZJQAEQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid (CAS 5305-59-9), with molecular formula C6H8N2O2S and molecular weight 172.03 g/mol. IUPAC: 4-methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid.
Chemical Property Profile of 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid
Property Insights of 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid. Following Lipinski's Rule of Five, 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic 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 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid?
The CAS number of 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid is 5305-59-9.
What is the molecular formula of 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid?
The molecular formula of 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid is C6H8N2O2S.
What is the molecular weight of 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid?
The molecular weight of 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid is 172.03 g/mol.
Where can I buy 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid?
You can request a quote for 4-Methyl-2-(methylamino)-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-(methylamino)-1,3-thiazole-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-2-(methylamino)-1,3-thiazole-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.