Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate
TL;DR: Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate (CAS 352661-22-4) is a chemical compound with molecular formula C14H12N4O3 and molecular weight 284.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)oxy]benzoate
Also Known As: METHYL 4-({3-METHYL-[1,2,4]TRIAZOLO[4,3-B]PYRIDAZIN-6-YL}OXY)BENZOATE, AJ-292/37143027, methyl4-({3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}oxy)benzoate, Methyl 4-((3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)oxy)benzoate, methyl 4-[(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)oxy]benzoate
| Molecular Formula | C14H12N4O3 |
|---|---|
| Molecular Weight | 284.09 g/mol |
| LogP | 2.01162 |
| Topological Polar Surface Area | 78.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.09094 |
| Heavy Atoms | 21 |
| Complexity | 795.5893 |
Chemical Identifiers
| CAS Number | 352661-22-4 |
|---|---|
| SMILES | CC1=NN=C2N1N=C(C=C2)OC3=CC=C(C=C3)C(=O)OC |
Product Overview
Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate (CAS 352661-22-4), with molecular formula C14H12N4O3 and molecular weight 284.09 g/mol. IUPAC: methyl 4-[(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)oxy]benzoate.
Chemical Property Profile of Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate
Property Insights of Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate
The XLogP value of 2.01162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate. The TPSA of 78.61 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate. Following Lipinski's Rule of Five, Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate has 0 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 Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate?
The CAS number of Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate is 352661-22-4.
What is the molecular formula of Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate?
The molecular formula of Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate is C14H12N4O3.
What is the molecular weight of Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate?
The molecular weight of Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate is 284.09 g/mol.
Where can I buy Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate?
You can request a quote for Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-({3-methyl-[1,2,4]triazolo[4,3-B]pyridazin-6-YL}oxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.