4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol
TL;DR: 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol (CAS 1212194-77-8) is a chemical compound with molecular formula C18H17N3OS and molecular weight 323.10922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-methoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione
Also Known As: 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol, 4-(2-methoxyphenyl)-3-[(1R,2R)-2-phenylcyclopropyl]-1H-1,2,4-triazole-5-thione, 4-(2-methoxyphenyl)-5-[(1R,2R)-2-phenylcyclopropyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Technical Specifications
| Molecular Formula | C18H17N3OS |
| Molecular Weight | 323.10922 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 69.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.10922 Da |
| Heavy Atoms | 23 |
| Complexity | 489.0 |
| SMILES | COC1=CC=CC=C1N2C(=NNC2=S)[C@@H]3C[C@H]3C4=CC=CC=C4 |
| InChIKey | CGPYXFDKOIJFLY-UONOGXRCSA-N |
Chemical Property Profile of 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol
Property Insights of 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol
The XLogP value of 3.4 indicates that 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol. Following Lipinski's Rule of Five, 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol 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-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol?
The CAS number of 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol is 1212194-77-8.
What is the molecular formula of 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol?
The molecular formula of 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol is C18H17N3OS.
What is the molecular weight of 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol?
The molecular weight of 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol is 323.10922 g/mol.
Where can I buy 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol?
You can request a quote for 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol?
Yes, CoreyChem provides custom synthesis services for 4-((R)-2-methoxyphenyl)-5-((1R,2R)-2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.