5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol
TL;DR: 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol (CAS 839686-38-3) is a chemical compound with molecular formula C11H7N3OS and molecular weight 229.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-quinolin-2-yl-3H-1,3,4-oxadiazole-2-thione
Also Known As: 5-(quinolin-2-yl)-1,3,4-oxadiazole-2-thiol, 5-(2-quinolyl)-1,3,4-oxadiazole-2-thiol, 5-(2-quinolinyl)-1,3,4-oxadiazole-2-thiol, J3.328.275C, 5-(quinolin-2-yl)-1,3,4-oxadiazole-2(3H)-thione
| Molecular Formula | C11H7N3OS |
|---|---|
| Molecular Weight | 229.03 g/mol |
| LogP | 2.94739 |
| Topological Polar Surface Area | 54.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.03099 |
| Heavy Atoms | 16 |
| Complexity | 701.2711 |
Chemical Identifiers
| CAS Number | 839686-38-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=N2)C3=NNC(=S)O3 |
Product Overview
5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol (CAS 839686-38-3), with molecular formula C11H7N3OS and molecular weight 229.03 g/mol. IUPAC: 5-quinolin-2-yl-3H-1,3,4-oxadiazole-2-thione.
Chemical Property Profile of 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol
Property Insights of 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol
The XLogP value of 2.94739 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol. With a topological polar surface area (TPSA) of 54.71 Ų, 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol has 1 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-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol?
The CAS number of 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol is 839686-38-3.
What is the molecular formula of 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol?
The molecular formula of 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol is C11H7N3OS.
What is the molecular weight of 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol?
The molecular weight of 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol is 229.03 g/mol.
Where can I buy 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol?
You can request a quote for 5-(Quinolin-2-yl)-1,3,4-oxadiazole-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-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-(Quinolin-2-yl)-1,3,4-oxadiazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.