s-Triazole, 5-phenyl-3-(o-tolyl)-
TL;DR: s-Triazole, 5-phenyl-3-(o-tolyl)- (CAS 60510-57-8) is a chemical compound with molecular formula C15H13N3 and molecular weight 235.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-methylphenyl)-3-phenyl-1H-1,2,4-triazole
Also Known As: 5-Phenyl-3-(o-tolyl)-s-triazole, s-Triazole, 5-phenyl-3-(o-tolyl)-, 3-(2-Methylphenyl)-5-phenyl-1H-1,2,4-triazole, 1H-1,2,4-Triazole, 3-(2-methylphenyl)-5-phenyl-, 5-(2-methylphenyl)-3-phenyl-1H-1,2,4-triazole
| Molecular Formula | C15H13N3 |
|---|---|
| Molecular Weight | 235.11 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.11095 |
| Heavy Atoms | 18 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 60510-57-8 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NC(=NN2)C3=CC=CC=C3 |
| InChIKey | LUPHUKWXQVNVCX-UHFFFAOYSA-N |
Product Overview
s-Triazole, 5-phenyl-3-(o-tolyl)- (CAS 60510-57-8), with molecular formula C15H13N3 and molecular weight 235.11 g/mol. IUPAC: 5-(2-methylphenyl)-3-phenyl-1H-1,2,4-triazole.
Chemical Property Profile of s-Triazole, 5-phenyl-3-(o-tolyl)-
Property Insights of s-Triazole, 5-phenyl-3-(o-tolyl)-
The XLogP value of 3.7 indicates that s-Triazole, 5-phenyl-3-(o-tolyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, s-Triazole, 5-phenyl-3-(o-tolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, s-Triazole, 5-phenyl-3-(o-tolyl)- 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 s-Triazole, 5-phenyl-3-(o-tolyl)-?
The CAS number of s-Triazole, 5-phenyl-3-(o-tolyl)- is 60510-57-8.
What is the molecular formula of s-Triazole, 5-phenyl-3-(o-tolyl)-?
The molecular formula of s-Triazole, 5-phenyl-3-(o-tolyl)- is C15H13N3.
What is the molecular weight of s-Triazole, 5-phenyl-3-(o-tolyl)-?
The molecular weight of s-Triazole, 5-phenyl-3-(o-tolyl)- is 235.11 g/mol.
Where can I buy s-Triazole, 5-phenyl-3-(o-tolyl)-?
You can request a quote for s-Triazole, 5-phenyl-3-(o-tolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for s-Triazole, 5-phenyl-3-(o-tolyl)-?
Yes, KEHONG BIO provides custom synthesis services for s-Triazole, 5-phenyl-3-(o-tolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.