4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole
TL;DR: 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole (CAS 321526-12-9) is a chemical compound with molecular formula C13H16N2O4S and molecular weight 296.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,4-dimethoxyphenyl)-3-methyl-1-methylsulfonylpyrazole
Also Known As: 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole, 4-(3,4-dimethoxyphenyl)-1-methanesulfonyl-3-methyl-1H-pyrazole, 1G-041, 4-(3,4-dimethoxyphenyl)-3-methyl-1-methylsulfonylpyrazole, 4-(3,4-dimethoxyphenyl)-1-methanesulfonyl-3-methylpyrazole
| Molecular Formula | C13H16N2O4S |
|---|---|
| Molecular Weight | 296.08 g/mol |
| LogP | 1.68342 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.08307 |
| Heavy Atoms | 20 |
| Complexity | 734.8246 |
Chemical Identifiers
| CAS Number | 321526-12-9 |
|---|---|
| SMILES | CC1=NN(C=C1C2=CC(=C(C=C2)OC)OC)S(=O)(=O)C |
Product Overview
4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole (CAS 321526-12-9), with molecular formula C13H16N2O4S and molecular weight 296.08 g/mol. IUPAC: 4-(3,4-dimethoxyphenyl)-3-methyl-1-methylsulfonylpyrazole.
Chemical Property Profile of 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole
Property Insights of 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole
The XLogP value of 1.68342 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole. Following Lipinski's Rule of Five, 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole has 0 hydrogen bond donor(s) and 5 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 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole?
The CAS number of 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole is 321526-12-9.
What is the molecular formula of 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole?
The molecular formula of 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole is C13H16N2O4S.
What is the molecular weight of 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole?
The molecular weight of 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole is 296.08 g/mol.
Where can I buy 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole?
You can request a quote for 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,4-dimethoxyphenyl)-3-methyl-1-(methylsulfonyl)-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.