2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid
TL;DR: 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid (CAS 104473-90-7) is a chemical compound with molecular formula C24H39NO9S and molecular weight 517.23456 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethyl-2-[1-ethylsulfanyl-3-(2-methylphenoxy)propan-2-yl]oxyethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid, n,n-diethyl-2-{[1-(ethylsulfanyl)-3-(2-methylphenoxy)propan-2-yl]oxy}ethanamine 2-hydroxypropane-1,2,3-tricarboxylate(1:1), N,N-diethyl-2-[1-ethylsulfanyl-3-(2-methylphenoxy)propan-2-yl]oxyethanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid, N,N-diethyl-2-[1-ethylsulfanyl-3-(2-methylphenoxy)propan-2-yl]oxyethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid
Technical Specifications
| Molecular Formula | C24H39NO9S |
| Molecular Weight | 517.23456 g/mol |
| XLogP | 2.60542 |
| Topological Polar Surface Area (TPSA) | 179.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 17 |
| Exact Mass | 517.23456 Da |
| Heavy Atoms | 35 |
| Complexity | 489.0 |
| SMILES | CCN(CC)CCOC(COC1=CC=CC=C1C)CSCC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| InChIKey | OAYCOTXBNCZKAA-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid
Property Insights of 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid
The XLogP value of 2.60542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid. The TPSA of 179.0 Ų indicates high polarity, suggesting 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid?
The CAS number of 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid is 104473-90-7.
What is the molecular formula of 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid?
The molecular formula of 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid is C24H39NO9S.
What is the molecular weight of 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid?
The molecular weight of 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid is 517.23456 g/mol.
Where can I buy 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid?
You can request a quote for 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid?
Yes, CoreyChem provides custom synthesis services for 2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.