4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine
TL;DR: 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine (CAS 276237-24-2) is a chemical compound with molecular formula C14H15N3O3 and molecular weight 273.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-yl)-5-piperidin-4-yl-1,2,4-oxadiazole
Also Known As: Peakdale1_002580, 4-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine, 3,4-Dimethylbenzonitrile, 3,3-Bis(p-hydroxyphenyl)oxindole, 0645AF
| Molecular Formula | C14H15N3O3 |
|---|---|
| Molecular Weight | 273.11 g/mol |
| LogP | 1.9323 |
| Topological Polar Surface Area | 69.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.11133 |
| Heavy Atoms | 20 |
| Complexity | 619.8767 |
Chemical Identifiers
| CAS Number | 276237-24-2 |
|---|---|
| SMILES | C1CNCCC1C2=NC(=NO2)C3=CC4=C(C=C3)OCO4 |
Product Overview
4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine (CAS 276237-24-2), with molecular formula C14H15N3O3 and molecular weight 273.11 g/mol. IUPAC: 3-(1,3-benzodioxol-5-yl)-5-piperidin-4-yl-1,2,4-oxadiazole.
Chemical Property Profile of 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine
Property Insights of 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine
The XLogP value of 1.9323 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine. The TPSA of 69.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine. Following Lipinski's Rule of Five, 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine has 1 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 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine?
The CAS number of 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine is 276237-24-2.
What is the molecular formula of 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine?
The molecular formula of 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine is C14H15N3O3.
What is the molecular weight of 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine?
The molecular weight of 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine is 273.11 g/mol.
Where can I buy 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine?
You can request a quote for 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-(1,3-Benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.