2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole
TL;DR: 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole (CAS 58695-70-8) is a chemical compound with molecular formula C15H11ClN2OS and molecular weight 302.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole
Also Known As: BAS 00243124, AB00081828-01, 2-benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole, 2-(benzylsulfanyl)-5-(2-chlorophenyl)-1,3,4-oxadiazole, 2-(benzylthio)-5-(2-chlorophenyl)-1,3,4-oxadiazole
| Molecular Formula | C15H11ClN2OS |
|---|---|
| Molecular Weight | 302.03 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 64.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.02808 |
| Heavy Atoms | 20 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 58695-70-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NN=C(O2)C3=CC=CC=C3Cl |
| InChIKey | SITUXKTUGUGDRO-UHFFFAOYSA-N |
Product Overview
2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole (CAS 58695-70-8), with molecular formula C15H11ClN2OS and molecular weight 302.03 g/mol. IUPAC: 2-benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole.
Chemical Property Profile of 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole
Property Insights of 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole
The XLogP value of 4.4 indicates that 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole. Following Lipinski's Rule of Five, 2-Benzylsulfanyl-5-(2-chlorophenyl)-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-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole?
The CAS number of 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole is 58695-70-8.
What is the molecular formula of 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole?
The molecular formula of 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole is C15H11ClN2OS.
What is the molecular weight of 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole?
The molecular weight of 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole is 302.03 g/mol.
Where can I buy 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole?
You can request a quote for 2-Benzylsulfanyl-5-(2-chlorophenyl)-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-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzylsulfanyl-5-(2-chlorophenyl)-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.