![1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol structure](/static/products/1052/105219-34-9.webp)
1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol
TL;DR: 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol (CAS 105219-34-9) is a chemical compound with molecular formula C9H10N4OS and molecular weight 222.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methoxyphenyl)methyl]-2H-tetrazole-5-thione
Also Known As: 1-(4-methoxybenzyl)-1H-tetrazole-5-thiol, 1-p-Methoxybenzyl-5-Tetrazolethiol, 1-[(4-methoxyphenyl)methyl]-2H-tetrazole-5-thione, 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol, 1-(4-Methoxybenzyl)-1H-1,2,3,4-tetrazol-5-thiol
| Molecular Formula | C9H10N4OS |
|---|---|
| Molecular Weight | 222.06 g/mol |
| LogP | 1.39259 |
| Topological Polar Surface Area | 55.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.05753 |
| Heavy Atoms | 15 |
| Complexity | 487.3135 |
Chemical Identifiers
| CAS Number | 105219-34-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2C(=S)N=NN2 |
Product Overview
1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol (CAS 105219-34-9), with molecular formula C9H10N4OS and molecular weight 222.06 g/mol. IUPAC: 1-[(4-methoxyphenyl)methyl]-2H-tetrazole-5-thione.
Chemical Property Profile of 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol
Property Insights of 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol
The XLogP value of 1.39259 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol. With a topological polar surface area (TPSA) of 55.73 Ų, 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol has 1 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-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol?
The CAS number of 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol is 105219-34-9.
What is the molecular formula of 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol?
The molecular formula of 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol is C9H10N4OS.
What is the molecular weight of 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol?
The molecular weight of 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol is 222.06 g/mol.
Where can I buy 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol?
You can request a quote for 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-methoxyphenyl)methyl]-1H-1,2,3,4-tetrazole-5-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.