1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione
TL;DR: 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione (CAS 52127-86-3) is a chemical compound with molecular formula C10H12N4S and molecular weight 220.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4,6-trimethylphenyl)-2H-tetrazole-5-thione
Also Known As: 1-mesityl-1h-tetrazole-5-thiol, 1-(2,4,6-trimethylphenyl)tetrazole-5-thiol, 1-(2,4,6-Trimethyl-phenyl)-1H-tetrazole-5-thiol, 1-(2,4,6-trimethylphenyl)-2H-tetrazole-5-thione, 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione
| Molecular Formula | C10H12N4S |
|---|---|
| Molecular Weight | 220.08 g/mol |
| LogP | 2.25015 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.07826 |
| Heavy Atoms | 15 |
| Complexity | 529.5403 |
Chemical Identifiers
| CAS Number | 52127-86-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)N2C(=S)N=NN2)C |
Product Overview
1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione (CAS 52127-86-3), with molecular formula C10H12N4S and molecular weight 220.08 g/mol. IUPAC: 1-(2,4,6-trimethylphenyl)-2H-tetrazole-5-thione.
Chemical Property Profile of 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione
Property Insights of 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione
The XLogP value of 2.25015 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione. With a topological polar surface area (TPSA) of 46.5 Ų, 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione has 1 hydrogen bond donor(s) and 3 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 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione?
The CAS number of 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione is 52127-86-3.
What is the molecular formula of 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione?
The molecular formula of 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione is C10H12N4S.
What is the molecular weight of 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione?
The molecular weight of 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione is 220.08 g/mol.
Where can I buy 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione?
You can request a quote for 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dihydro-1-(2,4,6-trimethylphenyl)-5H-tetrazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.