3-Phenyl-5-p-tolyl-S-triazole
TL;DR: 3-Phenyl-5-p-tolyl-S-triazole (CAS 33140-05-5) 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-(4-methylphenyl)-3-phenyl-1H-1,2,4-triazole
Also Known As: 3-Phenyl-5-p-tolyl-S-triazole, s-Triazole,3-methyl-5-o-tolyl, S-Triazole, 3-phenyl-5-p-tolyl-, S-Triazole,3-phenyl-5-p-tolyl, 5-(4-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 | 254.0 |
Chemical Identifiers
| CAS Number | 33140-05-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=NN2)C3=CC=CC=C3 |
| InChIKey | OGSBRDJAMKKTRH-UHFFFAOYSA-N |
Product Overview
3-Phenyl-5-p-tolyl-S-triazole (CAS 33140-05-5), with molecular formula C15H13N3 and molecular weight 235.11 g/mol. IUPAC: 5-(4-methylphenyl)-3-phenyl-1H-1,2,4-triazole.
Chemical Property Profile of 3-Phenyl-5-p-tolyl-S-triazole
Property Insights of 3-Phenyl-5-p-tolyl-S-triazole
The XLogP value of 3.7 indicates that 3-Phenyl-5-p-tolyl-S-triazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, 3-Phenyl-5-p-tolyl-S-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-5-p-tolyl-S-triazole 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 3-Phenyl-5-p-tolyl-S-triazole?
The CAS number of 3-Phenyl-5-p-tolyl-S-triazole is 33140-05-5.
What is the molecular formula of 3-Phenyl-5-p-tolyl-S-triazole?
The molecular formula of 3-Phenyl-5-p-tolyl-S-triazole is C15H13N3.
What is the molecular weight of 3-Phenyl-5-p-tolyl-S-triazole?
The molecular weight of 3-Phenyl-5-p-tolyl-S-triazole is 235.11 g/mol.
Where can I buy 3-Phenyl-5-p-tolyl-S-triazole?
You can request a quote for 3-Phenyl-5-p-tolyl-S-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-5-p-tolyl-S-triazole?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-5-p-tolyl-S-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.