![2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole structure](/static/products/6927/692771-54-3.webp)
2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole
TL;DR: 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole (CAS 692771-54-3) is a chemical compound with molecular formula C18H14BrN3OS and molecular weight 399.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole
Also Known As: 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole, 3-({5-[(4-bromobenzyl)thio]-1,3,4-oxadiazol-2-yl}methyl)-1H-indole, 2-[(4-bromobenzyl)thio]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole, 2-[(4-bromophenyl)methylthio]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole, 3-({5-[(4-bromobenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)-1H-indole
| Molecular Formula | C18H14BrN3OS |
|---|---|
| Molecular Weight | 399.00 g/mol |
| LogP | 5.1965 |
| Topological Polar Surface Area | 54.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.0041 |
| Heavy Atoms | 24 |
| Complexity | 961.7362 |
Chemical Identifiers
| CAS Number | 692771-54-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CC3=NN=C(O3)SCC4=CC=C(C=C4)Br |
Product Overview
2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole (CAS 692771-54-3), with molecular formula C18H14BrN3OS and molecular weight 399.00 g/mol. IUPAC: 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole.
Chemical Property Profile of 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole
Property Insights of 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole
The XLogP value of 5.1965 indicates that 2-[(4-bromophenyl)methylsulfanyl]-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-[(4-bromophenyl)methylsulfanyl]-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-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole?
The CAS number of 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole is 692771-54-3.
What is the molecular formula of 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole?
The molecular formula of 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole is C18H14BrN3OS.
What is the molecular weight of 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole?
The molecular weight of 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole is 399.00 g/mol.
Where can I buy 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole?
You can request a quote for 2-[(4-bromophenyl)methylsulfanyl]-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-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-bromophenyl)methylsulfanyl]-5-(1H-indol-3-ylmethyl)-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.