![5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole structure](/static/products/800/80085-63-8.png)
5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole
TL;DR: 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole (CAS 80085-63-8) is a chemical compound with molecular formula C10H12N4OS and molecular weight 236.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-methoxyphenyl)methylsulfanyl]-1-methyltetrazole
Also Known As: 5-p-methoxybenzylthio-1-methyltetrazole, BAS 00829312, BIM-0013670.P001, J3.486.772K, 1-Methyl-5-(4-methoxybenzylthio)-1H-tetrazole
| Molecular Formula | C10H12N4OS |
|---|---|
| Molecular Weight | 236.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.07318 |
| Heavy Atoms | 16 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 80085-63-8 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC2=CC=C(C=C2)OC |
| InChIKey | ZTBWCQVXFXJPSC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole (CAS 80085-63-8), with molecular formula C10H12N4OS and molecular weight 236.07 g/mol. IUPAC: 5-[(4-methoxyphenyl)methylsulfanyl]-1-methyltetrazole.
Chemical Property Profile of 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole
Property Insights of 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole. Following Lipinski's Rule of Five, 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole 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-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole?
The CAS number of 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole is 80085-63-8.
What is the molecular formula of 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole?
The molecular formula of 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole is C10H12N4OS.
What is the molecular weight of 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole?
The molecular weight of 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole is 236.07 g/mol.
Where can I buy 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole?
You can request a quote for 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-Methoxyphenyl)methylsulfanyl]-1-methyltetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.