Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate
TL;DR: Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate (CAS 131786-61-3) is a chemical compound with molecular formula C12H11NO3S and molecular weight 249.04596 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzoate
Also Known As: methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzoate, 3H-429S, methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate, 2-(4-carbomethoxyphenyl)-4-hydroxy-5-methylthiazole, methyl 4-(4-hydroxy-5-methyl-thiazol-2-yl)benzoate
Technical Specifications
| Molecular Formula | C12H11NO3S |
| Molecular Weight | 249.04596 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 87.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.04596 Da |
| Heavy Atoms | 17 |
| Complexity | 279.0 |
| SMILES | CC1=C(N=C(S1)C2=CC=C(C=C2)C(=O)OC)O |
| InChIKey | PIMOKRKXBVBGIP-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate
Property Insights of Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate. Following Lipinski's Rule of Five, Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate?
The CAS number of Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate is 131786-61-3.
What is the molecular formula of Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate?
The molecular formula of Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate is C12H11NO3S.
What is the molecular weight of Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate?
The molecular weight of Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate is 249.04596 g/mol.
Where can I buy Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate?
You can request a quote for Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-(4-hydroxy-5-methyl-1,3-thiazol-2-yl)benzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.