3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole
TL;DR: 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole (CAS 276236-98-7) is a chemical compound with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-5-piperidin-4-yl-1,2,4-oxadiazole
Also Known As: Maybridge3_006877, 3-(4-chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole, 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidine, 3-(4-chlorophenyl)-5-piperidin-4-yl-1,2,4-oxadiazole, IDI1_018264
| Molecular Formula | C13H14ClN3O |
|---|---|
| Molecular Weight | 263.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 51.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.08255 |
| Heavy Atoms | 18 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 276236-98-7 |
|---|---|
| SMILES | C1CNCCC1C2=NC(=NO2)C3=CC=C(C=C3)Cl |
| InChIKey | FVBMDOHBBQWMHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole (CAS 276236-98-7), with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol. IUPAC: 3-(4-chlorophenyl)-5-piperidin-4-yl-1,2,4-oxadiazole.
Chemical Property Profile of 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole
Property Insights of 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole. With a topological polar surface area (TPSA) of 51.0 Ų, 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole has 1 hydrogen bond donor(s) and 4 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 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole?
The CAS number of 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole is 276236-98-7.
What is the molecular formula of 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole?
The molecular formula of 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole is C13H14ClN3O.
What is the molecular weight of 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole?
The molecular weight of 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole is 263.08 g/mol.
Where can I buy 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole?
You can request a quote for 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-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-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-5-(piperidin-4-yl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.