2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole
TL;DR: 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole (CAS 892696-75-2) is a chemical compound with molecular formula C15H13ClN4O2S and molecular weight 348.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methyl]-5-(4-methylsulfonylphenyl)tetrazole
Also Known As: 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole, 2-(4-chlorobenzyl)-5-[4-(methylsulfonyl)phenyl]-2H-tetrazole, 2-[(4-chlorophenyl)methyl]-5-(4-methylsulfonylphenyl)tetrazole
| Molecular Formula | C15H13ClN4O2S |
|---|---|
| Molecular Weight | 348.04 g/mol |
| LogP | 2.4453 |
| Topological Polar Surface Area | 77.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.04477 |
| Heavy Atoms | 23 |
| Complexity | 918.87054 |
Chemical Identifiers
| CAS Number | 892696-75-2 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)C2=NN(N=N2)CC3=CC=C(C=C3)Cl |
Product Overview
2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole (CAS 892696-75-2), with molecular formula C15H13ClN4O2S and molecular weight 348.04 g/mol. IUPAC: 2-[(4-chlorophenyl)methyl]-5-(4-methylsulfonylphenyl)tetrazole.
Chemical Property Profile of 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole
Property Insights of 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole
The XLogP value of 2.4453 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole. The TPSA of 77.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole. Following Lipinski's Rule of Five, 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-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 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole?
The CAS number of 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole is 892696-75-2.
What is the molecular formula of 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole?
The molecular formula of 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole is C15H13ClN4O2S.
What is the molecular weight of 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole?
The molecular weight of 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole is 348.04 g/mol.
Where can I buy 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole?
You can request a quote for 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-chlorobenzyl)-5-(4-(methylsulfonyl)phenyl)-2H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.