2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid
TL;DR: 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid (CAS 77446-99-2) is a chemical compound with molecular formula C7H9NO2S2 and molecular weight 203.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)acetic acid
Also Known As: 2-[4-methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl]acetic acid, [4-methyl-2-(methylthio)-1,3-thiazol-5-yl]acetic acid, 2-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)acetic Acid, 2-(4-methyl-2-methylsulfanyl-thiazol-5-yl)acetic acid, 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid
| Molecular Formula | C7H9NO2S2 |
|---|---|
| Molecular Weight | 203.01 g/mol |
| LogP | 1.80052 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.00748 |
| Heavy Atoms | 12 |
| Complexity | 295.59653 |
Chemical Identifiers
| CAS Number | 77446-99-2 |
|---|---|
| SMILES | CC1=C(SC(=N1)SC)CC(=O)O |
Product Overview
2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid (CAS 77446-99-2), with molecular formula C7H9NO2S2 and molecular weight 203.01 g/mol. IUPAC: 2-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)acetic acid.
Chemical Property Profile of 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid
Property Insights of 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid
The XLogP value of 1.80052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid. With a topological polar surface area (TPSA) of 50.19 Ų, 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic 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 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid?
The CAS number of 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid is 77446-99-2.
What is the molecular formula of 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid?
The molecular formula of 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid is C7H9NO2S2.
What is the molecular weight of 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid?
The molecular weight of 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid is 203.01 g/mol.
Where can I buy 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid?
You can request a quote for 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic 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-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methyl-2-(methylsulfanyl)-1,3-thiazol-5-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.