5h-Tetrazole-5-thiol
TL;DR: 5h-Tetrazole-5-thiol (CAS 18686-81-2) is a chemical compound with molecular formula CH2N4S and molecular weight 102.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5H-tetrazole-5-thiol
Also Known As: 5h-tetrazole-5-thiol, 5H-Tetrazole-5-thione, 1,2-dihydro-
| Molecular Formula | CH2N4S |
|---|---|
| Molecular Weight | 102.00 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 102.000015 |
| Heavy Atoms | 6 |
| Complexity | 83.0 |
Chemical Identifiers
| CAS Number | 18686-81-2 |
|---|---|
| SMILES | C1(N=NN=N1)S |
| InChIKey | AITMSAKVDTXWBP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5h-Tetrazole-5-thiol (CAS 18686-81-2), with molecular formula CH2N4S and molecular weight 102.00 g/mol. IUPAC: 5H-tetrazole-5-thiol.
Chemical Property Profile of 5h-Tetrazole-5-thiol
Property Insights of 5h-Tetrazole-5-thiol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5h-Tetrazole-5-thiol. With a topological polar surface area (TPSA) of 50.4 Ų, 5h-Tetrazole-5-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5h-Tetrazole-5-thiol has 1 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 5h-Tetrazole-5-thiol?
The CAS number of 5h-Tetrazole-5-thiol is 18686-81-2.
What is the molecular formula of 5h-Tetrazole-5-thiol?
The molecular formula of 5h-Tetrazole-5-thiol is CH2N4S.
What is the molecular weight of 5h-Tetrazole-5-thiol?
The molecular weight of 5h-Tetrazole-5-thiol is 102.00 g/mol.
Where can I buy 5h-Tetrazole-5-thiol?
You can request a quote for 5h-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 5h-Tetrazole-5-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5h-Tetrazole-5-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.