1-Methyl-1,2,4-triazol-4-ium-4-amine
TL;DR: 1-Methyl-1,2,4-triazol-4-ium-4-amine (CAS 45470-35-7) is a chemical compound with molecular formula C3H7N4+ and molecular weight 99.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-1,2,4-triazol-4-ium-4-amine
Also Known As: 1-methyl-1,2,4-triazol-4-ium-4-amine, 1-Methyl-4-amino-4H-1,2,4-triazol-1-ium, 1-Methyl-4-amino-4H-1,2,4-triazolium, 4-amino-1-methyl-4H-1,2,4-triazol-1-ium, 1-Methyl-4-amino-1H-1,2,4-triazole-1-ium
| Molecular Formula | C3H7N4+ |
|---|---|
| Molecular Weight | 99.07 g/mol |
| LogP | -1.5786 |
| Topological Polar Surface Area | 47.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 99.06707 |
| Heavy Atoms | 7 |
| Complexity | 139.22345 |
Chemical Identifiers
| CAS Number | 45470-35-7 |
|---|---|
| SMILES | CN1C=[N+](C=N1)N |
Product Overview
1-Methyl-1,2,4-triazol-4-ium-4-amine (CAS 45470-35-7), with molecular formula C3H7N4+ and molecular weight 99.07 g/mol. IUPAC: 1-methyl-1,2,4-triazol-4-ium-4-amine.
Chemical Property Profile of 1-Methyl-1,2,4-triazol-4-ium-4-amine
Property Insights of 1-Methyl-1,2,4-triazol-4-ium-4-amine
The XLogP value of -1.5786 indicates that 1-Methyl-1,2,4-triazol-4-ium-4-amine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 47.72 Ų, 1-Methyl-1,2,4-triazol-4-ium-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-1,2,4-triazol-4-ium-4-amine 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 1-Methyl-1,2,4-triazol-4-ium-4-amine?
The CAS number of 1-Methyl-1,2,4-triazol-4-ium-4-amine is 45470-35-7.
What is the molecular formula of 1-Methyl-1,2,4-triazol-4-ium-4-amine?
The molecular formula of 1-Methyl-1,2,4-triazol-4-ium-4-amine is C3H7N4+.
What is the molecular weight of 1-Methyl-1,2,4-triazol-4-ium-4-amine?
The molecular weight of 1-Methyl-1,2,4-triazol-4-ium-4-amine is 99.07 g/mol.
Where can I buy 1-Methyl-1,2,4-triazol-4-ium-4-amine?
You can request a quote for 1-Methyl-1,2,4-triazol-4-ium-4-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-1,2,4-triazol-4-ium-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-1,2,4-triazol-4-ium-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.