![5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one structure](/static/products/4989/498-98-6.webp)
5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
TL;DR: 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one (CAS 498-98-6) is a chemical compound with molecular formula C7H7N3O and molecular weight 149.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2H-[1,2,4]triazolo[4,3-a]pyridin-3-one
Also Known As: s-Triazolo[4, 5-methyl-, 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one, 5-methyl-2H-[1,2,4]triazolo[4,3-a]pyridin-3-one, s-Triazolo[4,3-a]pyridin-3-ol, 5-methyl-, 5-Methyl-1,2,4-triazolo[4,3-a]pyridin-3(2H)-one
| Molecular Formula | C7H7N3O |
|---|---|
| Molecular Weight | 149.06 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 149.05891 |
| Heavy Atoms | 11 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 498-98-6 |
|---|---|
| SMILES | CC1=CC=CC2=NNC(=O)N12 |
| InChIKey | NEJANSQSQQBYLO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one (CAS 498-98-6), with molecular formula C7H7N3O and molecular weight 149.06 g/mol. IUPAC: 5-methyl-2H-[1,2,4]triazolo[4,3-a]pyridin-3-one.
Chemical Property Profile of 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Property Insights of 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one. With a topological polar surface area (TPSA) of 44.7 Ų, 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one has 1 hydrogen bond donor(s) and 2 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 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one?
The CAS number of 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one is 498-98-6.
What is the molecular formula of 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one?
The molecular formula of 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one is C7H7N3O.
What is the molecular weight of 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one?
The molecular weight of 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one is 149.06 g/mol.
Where can I buy 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one?
You can request a quote for 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.