![4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione structure](/static/products/1005/1005623-70-0.webp)
4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione
TL;DR: 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione (CAS 1005623-70-0) is a chemical compound with molecular formula C8H11N5S and molecular weight 209.07352 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione
Also Known As: 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione, 4-methyl-5-[(4-methylpyrazol-1-yl)methyl]-2H-1,2,4-triazole-3-thione, 4-methyl-5-[(4-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
Technical Specifications
| Molecular Formula | C8H11N5S |
| Molecular Weight | 209.07352 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 77.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.07352 Da |
| Heavy Atoms | 14 |
| Complexity | 277.0 |
| SMILES | CC1=CN(N=C1)CC2=NNC(=S)N2C |
| InChIKey | CTXXMOWLTNROJO-UHFFFAOYSA-N |
Chemical Property Profile of 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione
Property Insights of 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione. The TPSA of 77.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione. Following Lipinski's Rule of Five, 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione 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
What is the CAS number of 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione?
The CAS number of 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione is 1005623-70-0.
What is the molecular formula of 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione?
The molecular formula of 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione is C8H11N5S.
What is the molecular weight of 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione?
The molecular weight of 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione is 209.07352 g/mol.
Where can I buy 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione?
You can request a quote for 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione?
Yes, CoreyChem provides custom synthesis services for 4-methyl-3-[(4-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.