5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid
TL;DR: 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid (CAS 84968-72-9) is a chemical compound with molecular formula C15H13N3O3S and molecular weight 315.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-methyl-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]acetic acid
Also Known As: 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid, PHTHALIC ANHYDRIDE-4-BORONIC ACID PINACOL ESTER, 1H-Pyrazole-4-acetic acid, 5-hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-, 2-[5-methyl-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]acetic acid, 1H-Pyrazole-4-aceticacid, 5-hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-
| Molecular Formula | C15H13N3O3S |
|---|---|
| Molecular Weight | 315.07 g/mol |
| LogP | 2.22462 |
| Topological Polar Surface Area | 87.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.06775 |
| Heavy Atoms | 22 |
| Complexity | 877.0773 |
Chemical Identifiers
| CAS Number | 84968-72-9 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=NC(=CS2)C3=CC=CC=C3)CC(=O)O |
Product Overview
5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid (CAS 84968-72-9), with molecular formula C15H13N3O3S and molecular weight 315.07 g/mol. IUPAC: 2-[5-methyl-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]acetic acid.
Chemical Property Profile of 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid
Property Insights of 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid
The XLogP value of 2.22462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid. The TPSA of 87.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid. Following Lipinski's Rule of Five, 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid has 2 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 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid?
The CAS number of 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid is 84968-72-9.
What is the molecular formula of 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid?
The molecular formula of 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid is C15H13N3O3S.
What is the molecular weight of 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid?
The molecular weight of 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid is 315.07 g/mol.
Where can I buy 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid?
You can request a quote for 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Hydroxy-3-methyl-1-(4-phenyl-2-thiazolyl)-1H-pyrazole-4-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.