2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one
TL;DR: 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one (CAS 26281-38-9) is a chemical compound with molecular formula C13H11N3O2 and molecular weight 241.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one
Also Known As: 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one, 1-(8-hydroxyquinolin-2-yl)-3-methyl-1h-pyrazol-5(4h)-one
| Molecular Formula | C13H11N3O2 |
|---|---|
| Molecular Weight | 241.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 65.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 241.08513 |
| Heavy Atoms | 18 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 26281-38-9 |
|---|---|
| SMILES | CC1=NN(C(=O)C1)C2=NC3=C(C=CC=C3O)C=C2 |
| InChIKey | IOKQCNDJCWGRCC-UHFFFAOYSA-N |
Product Overview
2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one (CAS 26281-38-9), with molecular formula C13H11N3O2 and molecular weight 241.09 g/mol. IUPAC: 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one.
Chemical Property Profile of 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one
Property Insights of 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one. Following Lipinski's Rule of Five, 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one has 1 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 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one?
The CAS number of 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one is 26281-38-9.
What is the molecular formula of 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one?
The molecular formula of 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one is C13H11N3O2.
What is the molecular weight of 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one?
The molecular weight of 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one is 241.09 g/mol.
Where can I buy 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one?
You can request a quote for 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(8-hydroxyquinolin-2-yl)-5-methyl-4H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.