![5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole structure](/static/products/3464/346458-72-8.webp)
5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole
TL;DR: 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole (CAS 346458-72-8) is a chemical compound with molecular formula C10H11N3S and molecular weight 205.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole
Also Known As: 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole, 3-(2-Methyl-benzylsulfanyl)-4H-[1,2,4]triazole, 3-[(2-methylphenyl)methylthio]-1H-1,2,4-triazole, 3-{[(2-METHYLPHENYL)METHYL]SULFANYL}-1H-1,2,4-TRIAZOLE
| Molecular Formula | C10H11N3S |
|---|---|
| Molecular Weight | 205.07 g/mol |
| LogP | 2.40542 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.06737 |
| Heavy Atoms | 14 |
| Complexity | 397.5092 |
Chemical Identifiers
| CAS Number | 346458-72-8 |
|---|---|
| SMILES | CC1=CC=CC=C1CSC2=NC=NN2 |
Product Overview
5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole (CAS 346458-72-8), with molecular formula C10H11N3S and molecular weight 205.07 g/mol. IUPAC: 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole.
Chemical Property Profile of 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole
Property Insights of 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole
The XLogP value of 2.40542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole. With a topological polar surface area (TPSA) of 41.57 Ų, 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole 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 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole?
The CAS number of 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole is 346458-72-8.
What is the molecular formula of 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole?
The molecular formula of 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole is C10H11N3S.
What is the molecular weight of 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole?
The molecular weight of 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole is 205.07 g/mol.
Where can I buy 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole?
You can request a quote for 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.