5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione
TL;DR: 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione (CAS 87468-08-4) is a chemical compound with molecular formula C7H5N3S3 and molecular weight 226.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione
Also Known As: 2-(1H-pyrazol-1-yl)ethanamine, 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione, 5-(Pyridin-2-ylthio)-1,3,4-thiadiazole-2-thiol, 5-(Pyridin-2-ylsulfanyl)-1,3,4-thiadiazole-2-thiol, 5-((PYRIDIN-2-YL)SULFANYL)-1,3,4-THIADIAZOLE-2-THIOL
| Molecular Formula | C7H5N3S3 |
|---|---|
| Molecular Weight | 226.96 g/mol |
| LogP | 2.74689 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.96455 |
| Heavy Atoms | 13 |
| Complexity | 433.49835 |
Chemical Identifiers
| CAS Number | 87468-08-4 |
|---|---|
| SMILES | C1=CC=NC(=C1)SC2=NNC(=S)S2 |
Product Overview
5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione (CAS 87468-08-4), with molecular formula C7H5N3S3 and molecular weight 226.96 g/mol. IUPAC: 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione.
Chemical Property Profile of 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione
Property Insights of 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione
The XLogP value of 2.74689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione. With a topological polar surface area (TPSA) of 41.57 Ų, 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione 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 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione?
The CAS number of 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione is 87468-08-4.
What is the molecular formula of 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione?
The molecular formula of 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione is C7H5N3S3.
What is the molecular weight of 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione?
The molecular weight of 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione is 226.96 g/mol.
Where can I buy 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione?
You can request a quote for 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-pyridin-2-ylsulfanyl-3H-1,3,4-thiadiazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.