1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole
TL;DR: 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole (CAS 957482-05-2) is a chemical compound with molecular formula C13H15BrN2O3S and molecular weight 358.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole
Also Known As: 1-(4-bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole, AP-263/43028055, 4-[(3,5-dimethylpyrazolyl)sulfonyl]-1-bromo-2-ethoxybenzene, 1-[(4-bromo-3-ethoxyphenyl)sulfonyl]-3,5-dimethyl-1H-pyrazole, 2-bromo-5-[(3,5-dimethyl-1H-pyrazol-1-yl)sulfonyl]phenyl ethyl ether
| Molecular Formula | C13H15BrN2O3S |
|---|---|
| Molecular Weight | 358.00 g/mol |
| LogP | 2.89814 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.9987 |
| Heavy Atoms | 20 |
| Complexity | 738.0697 |
Chemical Identifiers
| CAS Number | 957482-05-2 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)S(=O)(=O)N2C(=CC(=N2)C)C)Br |
Product Overview
1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole (CAS 957482-05-2), with molecular formula C13H15BrN2O3S and molecular weight 358.00 g/mol. IUPAC: 1-(4-bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole.
Chemical Property Profile of 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole
Property Insights of 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole
The XLogP value of 2.89814 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole. Following Lipinski's Rule of Five, 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole 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-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole?
The CAS number of 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole is 957482-05-2.
What is the molecular formula of 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole?
The molecular formula of 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole is C13H15BrN2O3S.
What is the molecular weight of 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole?
The molecular weight of 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole is 358.00 g/mol.
Where can I buy 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole?
You can request a quote for 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromo-3-ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.