2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole
TL;DR: 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole (CAS 893777-04-3) is a chemical compound with molecular formula C16H12N2O4 and molecular weight 296.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole
Also Known As: 2-(1,3-benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole, AO-080/43441970, 2-[(1,3-benzodioxol-5-yloxy)methyl]-5-phenyl-1,3,4-oxadiazole, 1,3,4-Oxadiazole, 2-[(1,3-benzodioxol-5-yloxy)methyl]-5-phenyl-, 1,3-benzodioxol-5-yl (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ether
| Molecular Formula | C16H12N2O4 |
|---|---|
| Molecular Weight | 296.08 g/mol |
| LogP | 3.0443 |
| Topological Polar Surface Area | 66.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.0797 |
| Heavy Atoms | 22 |
| Complexity | 785.84973 |
Chemical Identifiers
| CAS Number | 893777-04-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)OCC3=NN=C(O3)C4=CC=CC=C4 |
Product Overview
2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole (CAS 893777-04-3), with molecular formula C16H12N2O4 and molecular weight 296.08 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole.
Chemical Property Profile of 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole
Property Insights of 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole
The XLogP value of 3.0443 indicates that 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole. Following Lipinski's Rule of Five, 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole has 0 hydrogen bond donor(s) and 6 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-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole?
The CAS number of 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole is 893777-04-3.
What is the molecular formula of 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole?
The molecular formula of 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole is C16H12N2O4.
What is the molecular weight of 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole?
The molecular weight of 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole is 296.08 g/mol.
Where can I buy 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole?
You can request a quote for 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-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-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Benzodioxol-5-yloxymethyl)-5-phenyl-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.