1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole
TL;DR: 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole (CAS 693256-16-5) is a chemical compound with molecular formula C17H18N4S and molecular weight 310.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole
Also Known As: 1-phenyl-5-[(2,4,6-trimethylbenzyl)sulfanyl]-1H-tetrazole, 1-phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole
| Molecular Formula | C17H18N4S |
|---|---|
| Molecular Weight | 310.13 g/mol |
| LogP | 3.87986 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.1252 |
| Heavy Atoms | 22 |
| Complexity | 757.358 |
Chemical Identifiers
| CAS Number | 693256-16-5 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)CSC2=NN=NN2C3=CC=CC=C3)C |
Product Overview
1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole (CAS 693256-16-5), with molecular formula C17H18N4S and molecular weight 310.13 g/mol. IUPAC: 1-phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole.
Chemical Property Profile of 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole
Property Insights of 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole
The XLogP value of 3.87986 indicates that 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole 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-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole?
The CAS number of 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole is 693256-16-5.
What is the molecular formula of 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole?
The molecular formula of 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole is C17H18N4S.
What is the molecular weight of 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole?
The molecular weight of 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole is 310.13 g/mol.
Where can I buy 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole?
You can request a quote for 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.