4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole
TL;DR: 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole (CAS 1019130-37-0) is a chemical compound with molecular formula C14H17N5O2S and molecular weight 319.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-azidoethyl)-3,5-dimethyl-1-(4-methylphenyl)sulfonylpyrazole
Also Known As: 4-(2-azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole, 4-(2-azidoethyl)-3,5-dimethyl-1-(4-methylbenzenesulfonyl)pyrazole, 4-(2-azidoethyl)-3,5-dimethyl-1-(4-methylphenyl)sulfonyl-pyrazole, 4-(2-azidoethyl)-3,5-dimethyl-1-(4-methylphenyl)sulfonylpyrazole, 4-(2-Azidoethyl)-3,5-dimethyl-1-(toluene-4-sulphonyl)-1H-pyrazole
| Molecular Formula | C14H17N5O2S |
|---|---|
| Molecular Weight | 319.11 g/mol |
| LogP | 2.89816 |
| Topological Polar Surface Area | 100.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.1103 |
| Heavy Atoms | 22 |
| Complexity | 830.8633 |
Chemical Identifiers
| CAS Number | 1019130-37-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)CCN=[N+]=[N-])C |
Product Overview
4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole (CAS 1019130-37-0), with molecular formula C14H17N5O2S and molecular weight 319.11 g/mol. IUPAC: 4-(2-azidoethyl)-3,5-dimethyl-1-(4-methylphenyl)sulfonylpyrazole.
Chemical Property Profile of 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole
Property Insights of 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole
The XLogP value of 2.89816 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole. The TPSA of 100.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole. Following Lipinski's Rule of Five, 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)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 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole?
The CAS number of 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole is 1019130-37-0.
What is the molecular formula of 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole?
The molecular formula of 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole is C14H17N5O2S.
What is the molecular weight of 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole?
The molecular weight of 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole is 319.11 g/mol.
Where can I buy 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole?
You can request a quote for 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Azidoethyl)-3,5-dimethyl-1-(p-toluenesulfonyl)pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.