5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol
TL;DR: 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol (CAS 1024429-50-2) is a chemical compound with molecular formula C4H8N4S and molecular weight 144.04697 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(aminomethyl)-4-methyl-1H-1,2,4-triazole-5-thione
Also Known As: 5-(AMINOMETHYL)-4-METHYL-4H-1,2,4-TRIAZOLE-3-THIOL, 3-(aminomethyl)-4-methyl-1H-1,2,4-triazole-5-thione, 5-(aminomethyl)-4-methyl-2H-1,2,4-triazole-3-thione, F1386-0024
Technical Specifications
| Molecular Formula | C4H8N4S |
| Molecular Weight | 144.04697 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 85.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 144.04697 Da |
| Heavy Atoms | 9 |
| Complexity | 164.0 |
| SMILES | CN1C(=NNC1=S)CN |
| InChIKey | YZUVRJJJOHSLQG-UHFFFAOYSA-N |
Chemical Property Profile of 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol
Property Insights of 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol
The XLogP value of -0.9 indicates that 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 85.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol. Following Lipinski's Rule of Five, 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol?
The CAS number of 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol is 1024429-50-2.
What is the molecular formula of 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol?
The molecular formula of 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol is C4H8N4S.
What is the molecular weight of 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol?
The molecular weight of 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol is 144.04697 g/mol.
Where can I buy 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol?
You can request a quote for 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol?
Yes, CoreyChem provides custom synthesis services for 5-(Aminomethyl)-4-methyl-4H-1,2,4-triazole-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.