1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole
TL;DR: 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole (CAS 956239-86-4) is a chemical compound with molecular formula C13H16N2O3S and molecular weight 280.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-ethoxy-3-methylphenyl)sulfonyl-3-methylpyrazole
Also Known As: 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole, 1-(4-ethoxy-3-methylphenyl)sulfonyl-3-methylpyrazole, F1756-0366, AP-263/42911262, 1-[(4-ethoxy-3-methylphenyl)sulfonyl]-3-methylpyrazole
| Molecular Formula | C13H16N2O3S |
|---|---|
| Molecular Weight | 280.09 g/mol |
| LogP | 2.13564 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.08817 |
| Heavy Atoms | 19 |
| Complexity | 689.66394 |
Chemical Identifiers
| CAS Number | 956239-86-4 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)S(=O)(=O)N2C=CC(=N2)C)C |
Product Overview
1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole (CAS 956239-86-4), with molecular formula C13H16N2O3S and molecular weight 280.09 g/mol. IUPAC: 1-(4-ethoxy-3-methylphenyl)sulfonyl-3-methylpyrazole.
Chemical Property Profile of 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole
Property Insights of 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole
The XLogP value of 2.13564 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole. Following Lipinski's Rule of Five, 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole 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
Frequently Asked Questions
What is the CAS number of 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole?
The CAS number of 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole is 956239-86-4.
What is the molecular formula of 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole?
The molecular formula of 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole is C13H16N2O3S.
What is the molecular weight of 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole?
The molecular weight of 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole is 280.09 g/mol.
Where can I buy 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole?
You can request a quote for 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-((4-ethoxy-3-methylphenyl)sulfonyl)-3-methyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.