3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole
TL;DR: 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole (CAS 144165-21-9) is a chemical compound with molecular formula C10H10FN3O2S and molecular weight 255.04778 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-fluorophenyl)-4-methyl-5-methylsulfonyl-1,2,4-triazole
Also Known As: 3-(3-Fluorophenyl)-4-methyl-5-(methylsulfonyl)-1H-1,2,4-triazole, 1H-1,2,4-Triazole, 3-(3-fluorophenyl)-4-methyl-5-(methylsulfonyl)-, 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole, 3-(3-fluorophenyl)-4-methyl-5-methylsulfonyl-1,2,4-triazole, 3-(3-Fluorophenyl)-4-methyl-5-(methylsulfonyl)-4H-1,2,4-triazole
Technical Specifications
| Molecular Formula | C10H10FN3O2S |
| Molecular Weight | 255.04778 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 73.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.04778 Da |
| Heavy Atoms | 17 |
| Complexity | 370.0 |
| SMILES | CN1C(=NN=C1S(=O)(=O)C)C2=CC(=CC=C2)F |
| InChIKey | ACCNZTYMXIOJDO-UHFFFAOYSA-N |
Chemical Property Profile of 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole
Property Insights of 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole. Following Lipinski's Rule of Five, 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole?
The CAS number of 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole is 144165-21-9.
What is the molecular formula of 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole?
The molecular formula of 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole is C10H10FN3O2S.
What is the molecular weight of 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole?
The molecular weight of 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole is 255.04778 g/mol.
Where can I buy 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole?
You can request a quote for 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole?
Yes, CoreyChem provides custom synthesis services for 3-(3-Fluorophenyl)-5-(methanesulfonyl)-4-methyl-4H-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.