o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid
TL;DR: o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid (CAS 41741-86-0) is a chemical compound with molecular formula C17H14N4O3 and molecular weight 322.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]benzoic acid
Also Known As: C.I.Acid Yellow 59, o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid, BAS 00443486, J1.595.259H, 2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]benzoic acid
| Molecular Formula | C17H14N4O3 |
|---|---|
| Molecular Weight | 322.11 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 94.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.1066 |
| Heavy Atoms | 24 |
| Complexity | 566.0 |
| Solubility | 17.5 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 41741-86-0 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=CC=C2)N=NC3=CC=CC=C3C(=O)O |
| InChIKey | FEAMVHMFWBXBOJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid (CAS 41741-86-0), with molecular formula C17H14N4O3 and molecular weight 322.11 g/mol. IUPAC: 2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]benzoic acid.
Chemical Property Profile of o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid
Property Insights of o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid
The XLogP value of 3.4 indicates that o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.4 Ų falls within the moderate polarity range, balancing permeability and solubility for o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid. Following Lipinski's Rule of Five, o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid has 2 hydrogen bond donor(s) and 6 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 o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid?
The CAS number of o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid is 41741-86-0.
What is the molecular formula of o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid?
The molecular formula of o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid is C17H14N4O3.
What is the molecular weight of o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid?
The molecular weight of o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid is 322.11 g/mol.
Where can I buy o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid?
You can request a quote for o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for o-(5-Hydroxy-3-methyl-1-phenyl-4-pyrazolylazo)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.