1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole
TL;DR: 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole (CAS 1002513-67-8) is a chemical compound with molecular formula C12H14N2O2S and molecular weight 250.0776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,5-dimethylphenyl)sulfonyl-3-methylpyrazole
Also Known As: 1-(2,5-dimethylphenyl)sulfonyl-3-methylpyrazole, 1-[(2,5-dimethylphenyl)sulfonyl]-3-methylpyrazole, F1696-0169, 1-((2,5-dimethylphenyl)sulfonyl)-3-methyl-1H-pyrazole, 1-[(2,5-dimethylphenyl)sulfonyl]-3-methyl-1H-pyrazole
Technical Specifications
| Molecular Formula | C12H14N2O2S |
| Molecular Weight | 250.0776 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 60.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.0776 Da |
| Heavy Atoms | 17 |
| Complexity | 363.0 |
| SMILES | CC1=CC(=C(C=C1)C)S(=O)(=O)N2C=CC(=N2)C |
| InChIKey | MBSDBOYBHBYFBT-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole
Property Insights of 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole. Following Lipinski's Rule of Five, 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole has 0 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 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole?
The CAS number of 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole is 1002513-67-8.
What is the molecular formula of 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole?
The molecular formula of 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole is C12H14N2O2S.
What is the molecular weight of 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole?
The molecular weight of 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole is 250.0776 g/mol.
Where can I buy 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole?
You can request a quote for 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole?
Yes, CoreyChem provides custom synthesis services for 1-(2,5-Dimethylphenyl)sulfonyl-3-methylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.