4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid
TL;DR: 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid (CAS 85404-18-8) is a chemical compound with molecular formula C16H14N2O3 and molecular weight 282.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-oxo-2H-indazol-1-yl)phenyl]propanoic acid
Also Known As: 4-Hipma, 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid, 2-[4-(3-oxo-2H-indazol-1-yl)phenyl]propanoic acid, 2-[4-(3-Hydroxy-1H-indazol-1-yl)phenyl]propanoic acid, 2-[4-(3-oxo-2,3-dihydro-1h-indazol-1-yl)phenyl]propanoic acid
| Molecular Formula | C16H14N2O3 |
|---|---|
| Molecular Weight | 282.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.10043 |
| Heavy Atoms | 21 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 85404-18-8 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)N2C3=CC=CC=C3C(=O)N2)C(=O)O |
| InChIKey | LMECYQYJENXKQK-UHFFFAOYSA-N |
Product Overview
4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid (CAS 85404-18-8), with molecular formula C16H14N2O3 and molecular weight 282.10 g/mol. IUPAC: 2-[4-(3-oxo-2H-indazol-1-yl)phenyl]propanoic acid.
Chemical Property Profile of 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid
Property Insights of 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid. Following Lipinski's Rule of Five, 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic 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 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid?
The CAS number of 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid is 85404-18-8.
What is the molecular formula of 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid?
The molecular formula of 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid is C16H14N2O3.
What is the molecular weight of 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid?
The molecular weight of 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid is 282.10 g/mol.
Where can I buy 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid?
You can request a quote for 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((3-Hydroxy-1H-indazol-1-yl)phenyl)-2-methylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.