1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole
TL;DR: 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole (CAS 1003989-01-2) is a chemical compound with molecular formula C16H22N2O3S and molecular weight 322.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole
Also Known As: 1-(5-tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole, 1-{[5-(tert-butyl)-2-ethoxyphenyl]sulfonyl}-3-methylpyrazole, AP-263/42911266, F1756-0370, 1-((5-(tert-butyl)-2-ethoxyphenyl)sulfonyl)-3-methyl-1H-pyrazole
| Molecular Formula | C16H22N2O3S |
|---|---|
| Molecular Weight | 322.14 g/mol |
| LogP | 3.12472 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.1351 |
| Heavy Atoms | 22 |
| Complexity | 770.9289 |
Chemical Identifiers
| CAS Number | 1003989-01-2 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N2C=CC(=N2)C |
Product Overview
1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole (CAS 1003989-01-2), with molecular formula C16H22N2O3S and molecular weight 322.14 g/mol. IUPAC: 1-(5-tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole.
Chemical Property Profile of 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole
Property Insights of 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole
The XLogP value of 3.12472 indicates that 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole. Following Lipinski's Rule of Five, 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole 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-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole?
The CAS number of 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole is 1003989-01-2.
What is the molecular formula of 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole?
The molecular formula of 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole is C16H22N2O3S.
What is the molecular weight of 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole?
The molecular weight of 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole is 322.14 g/mol.
Where can I buy 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole?
You can request a quote for 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Tert-butyl-2-ethoxyphenyl)sulfonyl-3-methylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.