![5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole structure](/static/products/5680/5680-29-5.webp)
5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole
TL;DR: 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole (CAS 5680-29-5) is a chemical compound with molecular formula C16H16N4OS and molecular weight 312.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(4-methylphenoxy)ethylsulfanyl]-1-phenyltetrazole
Also Known As: BAS 00665321, 5-[2-(4-methylphenoxy)ethylsulfanyl]-1-phenyltetrazole, BIM-0009771.P001, AR-422/11668229, 5-{[2-(4-methylphenoxy)ethyl]sulfanyl}-1-phenyl-1H-tetraazole
| Molecular Formula | C16H16N4OS |
|---|---|
| Molecular Weight | 312.10 g/mol |
| LogP | 3.14182 |
| Topological Polar Surface Area | 52.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 312.1045 |
| Heavy Atoms | 22 |
| Complexity | 712.52545 |
Chemical Identifiers
| CAS Number | 5680-29-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCSC2=NN=NN2C3=CC=CC=C3 |
Product Overview
5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole (CAS 5680-29-5), with molecular formula C16H16N4OS and molecular weight 312.10 g/mol. IUPAC: 5-[2-(4-methylphenoxy)ethylsulfanyl]-1-phenyltetrazole.
Chemical Property Profile of 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole
Property Insights of 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole
The XLogP value of 3.14182 indicates that 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.83 Ų, 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole 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-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole?
The CAS number of 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole is 5680-29-5.
What is the molecular formula of 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole?
The molecular formula of 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole is C16H16N4OS.
What is the molecular weight of 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole?
The molecular weight of 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole is 312.10 g/mol.
Where can I buy 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole?
You can request a quote for 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-[2-(4-Methylphenoxy)ethylsulfanyl]-1-phenyltetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.