1-(4-Chlorophenyl)tetrazole-2-thione
TL;DR: 1-(4-Chlorophenyl)tetrazole-2-thione (CAS 27143-76-6) is a chemical compound with molecular formula C7H5ClN4S and molecular weight 211.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2H-tetrazole-5-thione
Also Known As: 1-(4-Chlorophenyl)-1H-tetrazole-5-thiol, 1-(4-Chloro-phenyl)-1H-tetrazole-5-thiol, 1-(4-Chlorophenyl)tetrazole-2-thione, 1-p-Chlorophenyltetrazole-2-thione, 1-(4-chlorophenyl)-2H-tetrazole-5-thione
| Molecular Formula | C7H5ClN4S |
|---|---|
| Molecular Weight | 211.99 g/mol |
| LogP | 1.97829 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.99234 |
| Heavy Atoms | 13 |
| Complexity | 457.84482 |
Chemical Identifiers
| CAS Number | 27143-76-6 |
|---|---|
| SMILES | C1=CC(=CC=C1N2C(=S)N=NN2)Cl |
Product Overview
1-(4-Chlorophenyl)tetrazole-2-thione (CAS 27143-76-6), with molecular formula C7H5ClN4S and molecular weight 211.99 g/mol. IUPAC: 1-(4-chlorophenyl)-2H-tetrazole-5-thione.
Chemical Property Profile of 1-(4-Chlorophenyl)tetrazole-2-thione
Property Insights of 1-(4-Chlorophenyl)tetrazole-2-thione
The XLogP value of 1.97829 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chlorophenyl)tetrazole-2-thione. With a topological polar surface area (TPSA) of 46.5 Ų, 1-(4-Chlorophenyl)tetrazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)tetrazole-2-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-(4-Chlorophenyl)tetrazole-2-thione?
The CAS number of 1-(4-Chlorophenyl)tetrazole-2-thione is 27143-76-6.
What is the molecular formula of 1-(4-Chlorophenyl)tetrazole-2-thione?
The molecular formula of 1-(4-Chlorophenyl)tetrazole-2-thione is C7H5ClN4S.
What is the molecular weight of 1-(4-Chlorophenyl)tetrazole-2-thione?
The molecular weight of 1-(4-Chlorophenyl)tetrazole-2-thione is 211.99 g/mol.
Where can I buy 1-(4-Chlorophenyl)tetrazole-2-thione?
You can request a quote for 1-(4-Chlorophenyl)tetrazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)tetrazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)tetrazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.