5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one
TL;DR: 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one (CAS 128772-83-8) is a chemical compound with molecular formula C6H4N2O2S and molecular weight 168.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-thiophen-2-yl-3H-1,3,4-oxadiazol-2-one
Also Known As: 5-thien-2-yl-1,3,4-oxadiazol-2(3H)-one, 5-thiophen-2-yl-3H-1,3,4-oxadiazol-2-one, 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one, 5-(thiophen-2-yl)-2,3-dihydro-1,3,4-oxadiazol-2-one, 1,3,4-Oxadiazol-2(3H)-one, 5-(2-thienyl)-
| Molecular Formula | C6H4N2O2S |
|---|---|
| Molecular Weight | 168.00 g/mol |
| LogP | 1.0914 |
| Topological Polar Surface Area | 58.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 167.99934 |
| Heavy Atoms | 11 |
| Complexity | 386.63522 |
Chemical Identifiers
| CAS Number | 128772-83-8 |
|---|---|
| SMILES | C1=CSC(=C1)C2=NNC(=O)O2 |
Product Overview
5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one (CAS 128772-83-8), with molecular formula C6H4N2O2S and molecular weight 168.00 g/mol. IUPAC: 5-thiophen-2-yl-3H-1,3,4-oxadiazol-2-one.
Chemical Property Profile of 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one
Property Insights of 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one
The XLogP value of 1.0914 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one. With a topological polar surface area (TPSA) of 58.89 Ų, 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one 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-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one?
The CAS number of 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one is 128772-83-8.
What is the molecular formula of 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one?
The molecular formula of 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one is C6H4N2O2S.
What is the molecular weight of 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one?
The molecular weight of 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one is 168.00 g/mol.
Where can I buy 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one?
You can request a quote for 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(Thiophen-2-yl)-1,3,4-oxadiazol-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.