![3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole structure](/static/products/844/844652-75-1.png)
3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole
TL;DR: 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole (CAS 844652-75-1) is a chemical compound with molecular formula C18H16Br2N2O2 and molecular weight 449.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromophenyl)-5-[(2-bromo-4-propan-2-ylphenoxy)methyl]-1,2,4-oxadiazole
Also Known As: 3-(4-bromophenyl)-5-[(2-bromo-4-propan-2-yl-phenoxy)methyl]-1,2,4-oxadiazole, 3-(4-bromophenyl)-5-[(2-bromo-4-propan-2-ylphenoxy)methyl]-1,2,4-oxadiazole, 3-(4-bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole, 5-((2-bromo-4-isopropylphenoxy)methyl)-3-(4-bromophenyl)-1,2,4-oxadiazole
| Molecular Formula | C18H16Br2N2O2 |
|---|---|
| Molecular Weight | 449.96 g/mol |
| LogP | 5.964 |
| Topological Polar Surface Area | 48.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 449.95786 |
| Heavy Atoms | 24 |
| Complexity | 829.2901 |
Chemical Identifiers
| CAS Number | 844652-75-1 |
|---|---|
| SMILES | CC(C)C1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CC=C(C=C3)Br)Br |
Product Overview
3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole (CAS 844652-75-1), with molecular formula C18H16Br2N2O2 and molecular weight 449.96 g/mol. IUPAC: 3-(4-bromophenyl)-5-[(2-bromo-4-propan-2-ylphenoxy)methyl]-1,2,4-oxadiazole.
Chemical Property Profile of 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole
Property Insights of 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole
The XLogP value of 5.964 indicates that 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.15 Ų, 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole has 0 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 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole?
The CAS number of 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole is 844652-75-1.
What is the molecular formula of 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole?
The molecular formula of 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole is C18H16Br2N2O2.
What is the molecular weight of 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole?
The molecular weight of 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole is 449.96 g/mol.
Where can I buy 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole?
You can request a quote for 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Bromophenyl)-5-{[2-bromo-4-(propan-2-yl)phenoxy]methyl}-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.