1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-
TL;DR: 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo- (CAS 58112-53-1) is a chemical compound with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]acetic acid
Also Known As: 2-(6-oxo-3-(p-tolyl)pyridazin-1(6H)-yl)acetic acid, 2-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]acetic acid, 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-, F0921-7026, [3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]acetic acid
| Molecular Formula | C13H12N2O3 |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 1.30332 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.0848 |
| Heavy Atoms | 18 |
| Complexity | 629.42975 |
Chemical Identifiers
| CAS Number | 58112-53-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)O |
Product Overview
1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo- (CAS 58112-53-1), with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol. IUPAC: 2-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]acetic acid.
Chemical Property Profile of 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-
Property Insights of 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-
The XLogP value of 1.30332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-. Following Lipinski's Rule of Five, 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo- has 1 hydrogen bond donor(s) and 3 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 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-?
The CAS number of 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo- is 58112-53-1.
What is the molecular formula of 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-?
The molecular formula of 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo- is C13H12N2O3.
What is the molecular weight of 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-?
The molecular weight of 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo- is 244.08 g/mol.
Where can I buy 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-?
You can request a quote for 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo-?
Yes, KEHONG BIO provides custom synthesis services for 1(6H)-Pyridazineacetic acid, 3-(4-methylphenyl)-6-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.