5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol
TL;DR: 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol (CAS 5757-43-7) is a chemical compound with molecular formula C7H7N3S2 and molecular weight 197.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione
Also Known As: Maybridge1_008646, 5-PYRIDIN-2-YL-4,5-DIHYDRO-1,3,4-THIADIAZOLE-2-THIOL, 5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione, 5-(Pyridin-2-yl)-4,5-dihydro-1,3,4-thiadiazole-2-thiol, 2-(2-pyridyl)-1,3,4-thiadiazoline-5-thiol
| Molecular Formula | C7H7N3S2 |
|---|---|
| Molecular Weight | 197.01 g/mol |
| LogP | 1.2061 |
| Topological Polar Surface Area | 36.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 197.00813 |
| Heavy Atoms | 12 |
| Complexity | 287.96277 |
Chemical Identifiers
| CAS Number | 5757-43-7 |
|---|---|
| SMILES | C1=CC=NC(=C1)C2NNC(=S)S2 |
Product Overview
5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol (CAS 5757-43-7), with molecular formula C7H7N3S2 and molecular weight 197.01 g/mol. IUPAC: 5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione.
Chemical Property Profile of 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol
Property Insights of 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol
The XLogP value of 1.2061 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol. With a topological polar surface area (TPSA) of 36.95 Ų, 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol has 2 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 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol?
The CAS number of 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol is 5757-43-7.
What is the molecular formula of 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol?
The molecular formula of 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol is C7H7N3S2.
What is the molecular weight of 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol?
The molecular weight of 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol is 197.01 g/mol.
Where can I buy 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol?
You can request a quote for 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol 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-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-Pyridin-2-YL-4,5-dihydro-1,3,4-thiadiazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.