5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole
TL;DR: 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole (CAS 892014-48-1) is a chemical compound with molecular formula C21H17BrN2O4 and molecular weight 440.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(1-bromonaphthalen-2-yl)oxymethyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole
Also Known As: 5-(((1-bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole, 5-[(1-bromonaphthalen-2-yl)oxymethyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole, 5-{[(1-bromonaphthalen-2-yl)oxy]methyl}-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole
| Molecular Formula | C21H17BrN2O4 |
|---|---|
| Molecular Weight | 440.04 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.03717 |
| Heavy Atoms | 28 |
| Complexity | 499.0 |
Chemical Identifiers
| CAS Number | 892014-48-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NOC(=N2)COC3=C(C4=CC=CC=C4C=C3)Br)OC |
| InChIKey | ZVCUZQFIYYBURH-UHFFFAOYSA-N |
Product Overview
5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole (CAS 892014-48-1), with molecular formula C21H17BrN2O4 and molecular weight 440.04 g/mol. IUPAC: 5-[(1-bromonaphthalen-2-yl)oxymethyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole.
Chemical Property Profile of 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole
Property Insights of 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole
The XLogP value of 5.2 indicates that 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole. Following Lipinski's Rule of Five, 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole?
The CAS number of 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole is 892014-48-1.
What is the molecular formula of 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole?
The molecular formula of 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole is C21H17BrN2O4.
What is the molecular weight of 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole?
The molecular weight of 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole is 440.04 g/mol.
Where can I buy 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole?
You can request a quote for 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-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 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(((1-Bromonaphthalen-2-yl)oxy)methyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.