1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-
TL;DR: 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl- (CAS 154106-14-6) is a chemical compound with molecular formula C10H11N3O2S and molecular weight 237.0572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-3-methylsulfonyl-5-phenyl-1,2,4-triazole
Also Known As: 1-Methyl-3-(methylsulfonyl)-5-phenyl-1H-1,2,4-triazole, 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-, 1-methyl-3-methylsulfonyl-5-phenyl-1,2,4-triazole, 1-Methyl-3-methylsulfonyl-5-phenyl-1H-1,2,4-triazole, 3-methanesulfonyl-1-methyl-5-phenyl-1H-1,2,4-triazole
Technical Specifications
| Molecular Formula | C10H11N3O2S |
| Molecular Weight | 237.0572 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 73.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.0572 Da |
| Heavy Atoms | 16 |
| Complexity | 332.0 |
| SMILES | CN1C(=NC(=N1)S(=O)(=O)C)C2=CC=CC=C2 |
| InChIKey | FOOBWIHZRUMZLC-UHFFFAOYSA-N |
Chemical Property Profile of 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-
Property Insights of 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-?
The CAS number of 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl- is 154106-14-6.
What is the molecular formula of 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-?
The molecular formula of 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl- is C10H11N3O2S.
What is the molecular weight of 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-?
The molecular weight of 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl- is 237.0572 g/mol.
Where can I buy 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-?
You can request a quote for 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl-?
Yes, CoreyChem provides custom synthesis services for 1H-1,2,4-Triazole, 1-methyl-3-(methylsulfonyl)-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.