2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole
TL;DR: 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole (CAS 854357-49-6) is a chemical compound with molecular formula C8H7ClN2OS and molecular weight 214.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-chloroethyl)-5-thiophen-2-yl-1,3,4-oxadiazole
Also Known As: 2-(1-chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole, 2-(1-chloroethyl)-5-thien-2-yl-1,3,4-oxadiazole, 2-(1-chloroethyl)-5-thiophen-2-yl-1,3,4-oxadiazole, 2-(1-Chloroethyl)-5-(2-thienyl)-1,3,4-oxadiazole
| Molecular Formula | C8H7ClN2OS |
|---|---|
| Molecular Weight | 214.00 g/mol |
| LogP | 3.0979 |
| Topological Polar Surface Area | 38.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.99677 |
| Heavy Atoms | 13 |
| Complexity | 382.5143 |
Chemical Identifiers
| CAS Number | 854357-49-6 |
|---|---|
| SMILES | CC(C1=NN=C(O1)C2=CC=CS2)Cl |
Product Overview
2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole (CAS 854357-49-6), with molecular formula C8H7ClN2OS and molecular weight 214.00 g/mol. IUPAC: 2-(1-chloroethyl)-5-thiophen-2-yl-1,3,4-oxadiazole.
Chemical Property Profile of 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole
Property Insights of 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole
The XLogP value of 3.0979 indicates that 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.92 Ų, 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole has 0 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 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole?
The CAS number of 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole is 854357-49-6.
What is the molecular formula of 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole?
The molecular formula of 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole is C8H7ClN2OS.
What is the molecular weight of 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole?
The molecular weight of 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole is 214.00 g/mol.
Where can I buy 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole?
You can request a quote for 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Chloroethyl)-5-(thiophen-2-yl)-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.