1-Methyl-1H-1,2,4-triazol-3-amine
TL;DR: 1-Methyl-1H-1,2,4-triazol-3-amine (CAS 49607-51-4) is a chemical compound with molecular formula C3H6N4 and molecular weight 98.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-1,2,4-triazol-3-amine
Also Known As: 1-Methyl-1H-1,2,4-triazol-3-amine, 1-methyl-1,2,4-triazol-3-amine, 1H-1,2,4-Triazol-3-amine, 1-methyl-, 3-amino-1-methyl-1,2,4-triazole, 1-Methyl-1H-[1,2,4]triazol-3-ylamine
| Molecular Formula | C3H6N4 |
|---|---|
| Molecular Weight | 98.06 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 56.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 98.05925 |
| Heavy Atoms | 7 |
| Complexity | 64.0 |
Chemical Identifiers
| CAS Number | 49607-51-4 |
|---|---|
| SMILES | CN1C=NC(=N1)N |
| InChIKey | CNSCXLZIKKHZND-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-1H-1,2,4-triazol-3-amine (CAS 49607-51-4), with molecular formula C3H6N4 and molecular weight 98.06 g/mol. IUPAC: 1-methyl-1,2,4-triazol-3-amine.
Chemical Property Profile of 1-Methyl-1H-1,2,4-triazol-3-amine
Property Insights of 1-Methyl-1H-1,2,4-triazol-3-amine
The XLogP value of -1.2 indicates that 1-Methyl-1H-1,2,4-triazol-3-amine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.7 Ų, 1-Methyl-1H-1,2,4-triazol-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-1H-1,2,4-triazol-3-amine 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-Methyl-1H-1,2,4-triazol-3-amine?
The CAS number of 1-Methyl-1H-1,2,4-triazol-3-amine is 49607-51-4.
What is the molecular formula of 1-Methyl-1H-1,2,4-triazol-3-amine?
The molecular formula of 1-Methyl-1H-1,2,4-triazol-3-amine is C3H6N4.
What is the molecular weight of 1-Methyl-1H-1,2,4-triazol-3-amine?
The molecular weight of 1-Methyl-1H-1,2,4-triazol-3-amine is 98.06 g/mol.
Where can I buy 1-Methyl-1H-1,2,4-triazol-3-amine?
You can request a quote for 1-Methyl-1H-1,2,4-triazol-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-1H-1,2,4-triazol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-1H-1,2,4-triazol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.