7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine
TL;DR: 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine (CAS 100078-89-5) is a chemical compound with molecular formula C12H10N4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-7-phenyl-[1,2,4]triazolo[4,3-b]pyridazine
Also Known As: 3-methyl-7-phenyl-[1,2,4]triazolo[4,3-b]pyridazine, 3-Methyl-7-phenyl-1,2,4-triazolo(4,3-b)pyridazine, 7-PHENYL-3-METHYL-1,2,4-TRIAZOLO-(4,3B)PYRIDAZINE, 1,2,4-Triazolo(4,3-b)pyridazine, 3-methyl-7-phenyl-, 1,2,4-Triazolo(4,3-b)pyridazine,3-methyl-7-phenyl
| Molecular Formula | C12H10N4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.09055 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 100078-89-5 |
|---|---|
| SMILES | CC1=NN=C2N1N=CC(=C2)C3=CC=CC=C3 |
| InChIKey | ZFHJWSHCGWBMLE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine (CAS 100078-89-5), with molecular formula C12H10N4 and molecular weight 210.09 g/mol. IUPAC: 3-methyl-7-phenyl-[1,2,4]triazolo[4,3-b]pyridazine.
Chemical Property Profile of 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine
Property Insights of 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine. With a topological polar surface area (TPSA) of 43.1 Ų, 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine has 0 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 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine?
The CAS number of 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine is 100078-89-5.
What is the molecular formula of 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine?
The molecular formula of 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine is C12H10N4.
What is the molecular weight of 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine?
The molecular weight of 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine is 210.09 g/mol.
Where can I buy 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine?
You can request a quote for 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine?
Yes, KEHONG BIO provides custom synthesis services for 7-Phenyl-3-methyl-1,2,4-triazolo-(4,3b)pyridazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.