3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine
TL;DR: 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine (CAS 144729-42-0) is a chemical compound with molecular formula C9H8Cl2N4S and molecular weight 273.98468 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,5-dichlorophenyl)-5-methylsulfanyl-1,2,4-triazol-4-amine
Also Known As: 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine, 4H-1,2,4-Triazol-4-amine, 3-(3,5-dichlorophenyl)-5-(methylthio)-, 3-(3,5-dichlorophenyl)-5-(methylsulfanyl)-1,2,4-triazol-4-amine, 3-(3,5-dichlorophenyl)-5-methylsulfanyl-1,2,4-triazol-4-amine, 3-(3,5-Dichlorophenyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Technical Specifications
| Molecular Formula | C9H8Cl2N4S |
| Molecular Weight | 273.98468 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 82.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.98468 Da |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
| SMILES | CSC1=NN=C(N1N)C2=CC(=CC(=C2)Cl)Cl |
| InChIKey | ZIXIUQDKIPPEHS-UHFFFAOYSA-N |
Chemical Property Profile of 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine
Property Insights of 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine. The TPSA of 82.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine. Following Lipinski's Rule of Five, 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine?
The CAS number of 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine is 144729-42-0.
What is the molecular formula of 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine?
The molecular formula of 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine is C9H8Cl2N4S.
What is the molecular weight of 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine?
The molecular weight of 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine is 273.98468 g/mol.
Where can I buy 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine?
You can request a quote for 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine?
Yes, CoreyChem provides custom synthesis services for 3-(3,5-dichlorophenyl)-5-(methylthio)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.