![2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile structure](/static/products/4853/485334-95-0.webp)
2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile
TL;DR: 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile (CAS 485334-95-0) is a chemical compound with molecular formula C8H5N3OS2 and molecular weight 222.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetonitrile
Also Known As: BAS 02533838, 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile, (5-Thiophen-2-yl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetonitrile, {[5-(Thiophen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetonitrile, 2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetonitrile
| Molecular Formula | C8H5N3OS2 |
|---|---|
| Molecular Weight | 222.99 g/mol |
| LogP | 2.41378 |
| Topological Polar Surface Area | 62.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.98741 |
| Heavy Atoms | 14 |
| Complexity | 443.35205 |
Chemical Identifiers
| CAS Number | 485334-95-0 |
|---|---|
| SMILES | C1=CSC(=C1)C2=NN=C(O2)SCC#N |
Product Overview
2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile (CAS 485334-95-0), with molecular formula C8H5N3OS2 and molecular weight 222.99 g/mol. IUPAC: 2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetonitrile.
Chemical Property Profile of 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile
Property Insights of 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile
The XLogP value of 2.41378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile. The TPSA of 62.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile. Following Lipinski's Rule of Five, 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile has 0 hydrogen bond donor(s) and 6 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 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile?
The CAS number of 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile is 485334-95-0.
What is the molecular formula of 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile?
The molecular formula of 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile is C8H5N3OS2.
What is the molecular weight of 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile?
The molecular weight of 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile is 222.99 g/mol.
Where can I buy 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile?
You can request a quote for 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[[5-(2-Thienyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.