2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole
TL;DR: 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole (CAS 69785-85-9) is a chemical compound with molecular formula C15H9FN2O3 and molecular weight 284.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole
Also Known As: 2-(1,3-benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole, BIM-0019824.P001, 2-(Benzo[d][1,3]dioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole, 5-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]-2H-benzo[d]1,3-dioxolane
| Molecular Formula | C15H9FN2O3 |
|---|---|
| Molecular Weight | 284.06 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 57.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.05972 |
| Heavy Atoms | 21 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 69785-85-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)C4=CC=CC=C4F |
| InChIKey | TZWURTRBMSOAKH-UHFFFAOYSA-N |
Product Overview
2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole (CAS 69785-85-9), with molecular formula C15H9FN2O3 and molecular weight 284.06 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole.
Chemical Property Profile of 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole
Property Insights of 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole
The XLogP value of 3.0 indicates that 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-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 57.4 Ų, 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-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-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole?
The CAS number of 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole is 69785-85-9.
What is the molecular formula of 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole?
The molecular formula of 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole is C15H9FN2O3.
What is the molecular weight of 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole?
The molecular weight of 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole is 284.06 g/mol.
Where can I buy 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole?
You can request a quote for 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-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-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Benzodioxol-5-yl)-5-(2-fluorophenyl)-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.