![5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol structure](/static/products/116/1164529-03-6.png)
5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol
TL;DR: 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol (CAS 1164529-03-6) is a chemical compound with molecular formula C18H17N3S and molecular weight 307.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione
Also Known As: 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol, 5-((1R,2R)-2-phenylcyclopropyl)-4-(p-tolyl)-4H-1,2,4-triazole-3-thiol, 4-(4-methylphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione, 4-(4-methylphenyl)-5-[(1R,2R)-2-phenylcyclopropyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
| Molecular Formula | C18H17N3S |
|---|---|
| Molecular Weight | 307.11 g/mol |
| LogP | 4.50941 |
| Topological Polar Surface Area | 33.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.11432 |
| Heavy Atoms | 22 |
| Complexity | 846.0437 |
Chemical Identifiers
| CAS Number | 1164529-03-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NNC2=S)[C@@H]3C[C@H]3C4=CC=CC=C4 |
Product Overview
5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol (CAS 1164529-03-6), with molecular formula C18H17N3S and molecular weight 307.11 g/mol. IUPAC: 4-(4-methylphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol
Property Insights of 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol
The XLogP value of 4.50941 indicates that 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.61 Ų, 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol 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 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol?
The CAS number of 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol is 1164529-03-6.
What is the molecular formula of 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol?
The molecular formula of 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol is C18H17N3S.
What is the molecular weight of 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol?
The molecular weight of 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol is 307.11 g/mol.
Where can I buy 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol?
You can request a quote for 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-((1R,2R)-2-Phenyl-cyclopropyl)-4-p-tolyl-4H-[1,2,4]triazole-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.