5-Ethylsulfonyl-1-phenyl-1H-tetrazole
TL;DR: 5-Ethylsulfonyl-1-phenyl-1H-tetrazole (CAS 3206-46-0) is a chemical compound with molecular formula C9H10N4O2S and molecular weight 238.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethylsulfonyl-1-phenyltetrazole
Also Known As: 5-ethylsulfonyl-1-phenyltetrazole, 5-(ethylsulfonyl)-1-phenyl-1H-tetrazole, 1H-Tetrazole, 5-(ethylsulfonyl)-1-phenyl-, 5-Ethylsulfonyl-1-phenyl-1H-tetrazole, 5-(ethylsulfonyl)-1-phenyl-1H-tetraazole
| Molecular Formula | C9H10N4O2S |
|---|---|
| Molecular Weight | 238.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 86.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.05244 |
| Heavy Atoms | 16 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 3206-46-0 |
|---|---|
| SMILES | CCS(=O)(=O)C1=NN=NN1C2=CC=CC=C2 |
| InChIKey | VZFCSFHTLJFUKD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Ethylsulfonyl-1-phenyl-1H-tetrazole (CAS 3206-46-0), with molecular formula C9H10N4O2S and molecular weight 238.05 g/mol. IUPAC: 5-ethylsulfonyl-1-phenyltetrazole.
Chemical Property Profile of 5-Ethylsulfonyl-1-phenyl-1H-tetrazole
Property Insights of 5-Ethylsulfonyl-1-phenyl-1H-tetrazole
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethylsulfonyl-1-phenyl-1H-tetrazole. The TPSA of 86.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Ethylsulfonyl-1-phenyl-1H-tetrazole. Following Lipinski's Rule of Five, 5-Ethylsulfonyl-1-phenyl-1H-tetrazole 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 5-Ethylsulfonyl-1-phenyl-1H-tetrazole?
The CAS number of 5-Ethylsulfonyl-1-phenyl-1H-tetrazole is 3206-46-0.
What is the molecular formula of 5-Ethylsulfonyl-1-phenyl-1H-tetrazole?
The molecular formula of 5-Ethylsulfonyl-1-phenyl-1H-tetrazole is C9H10N4O2S.
What is the molecular weight of 5-Ethylsulfonyl-1-phenyl-1H-tetrazole?
The molecular weight of 5-Ethylsulfonyl-1-phenyl-1H-tetrazole is 238.05 g/mol.
Where can I buy 5-Ethylsulfonyl-1-phenyl-1H-tetrazole?
You can request a quote for 5-Ethylsulfonyl-1-phenyl-1H-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethylsulfonyl-1-phenyl-1H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethylsulfonyl-1-phenyl-1H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.