2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole
TL;DR: 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole (CAS 693234-31-0) is a chemical compound with molecular formula C18H15N3OS and molecular weight 321.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole
Also Known As: 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole, 3-{[5-(benzylsulfanyl)-1,3,4-oxadiazol-2-yl]methyl}-1H-indole, 2-((1h-indol-3-yl)methyl)-5-(benzylthio)-1,3,4-oxadiazole, 2-(indol-3-ylmethyl)-5-(phenylmethylthio)-1,3,4-oxadiazole
| Molecular Formula | C18H15N3OS |
|---|---|
| Molecular Weight | 321.09 g/mol |
| LogP | 4.434 |
| Topological Polar Surface Area | 54.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 321.0936 |
| Heavy Atoms | 23 |
| Complexity | 914.08435 |
Chemical Identifiers
| CAS Number | 693234-31-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NN=C(O2)CC3=CNC4=CC=CC=C43 |
Product Overview
2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole (CAS 693234-31-0), with molecular formula C18H15N3OS and molecular weight 321.09 g/mol. IUPAC: 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole.
Chemical Property Profile of 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole
Property Insights of 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole
The XLogP value of 4.434 indicates that 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-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 54.71 Ų, 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole 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 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole?
The CAS number of 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole is 693234-31-0.
What is the molecular formula of 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole?
The molecular formula of 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole is C18H15N3OS.
What is the molecular weight of 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole?
The molecular weight of 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole is 321.09 g/mol.
Where can I buy 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole?
You can request a quote for 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-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-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-benzylsulfanyl-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.