3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole
TL;DR: 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole (CAS 854409-25-9) is a chemical compound with molecular formula C20H21N3O4S and molecular weight 399.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[1-(benzenesulfonyl)piperidin-4-yl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole
Also Known As: 1-(benzenesulfonyl)-4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]piperidine, 3-(4-methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole, F3382-0053, 5-[1-(benzenesulfonyl)piperidin-4-yl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole
| Molecular Formula | C20H21N3O4S |
|---|---|
| Molecular Weight | 399.13 g/mol |
| LogP | 3.3135 |
| Topological Polar Surface Area | 85.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.12527 |
| Heavy Atoms | 28 |
| Complexity | 1024.8275 |
Chemical Identifiers
| CAS Number | 854409-25-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NOC(=N2)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4 |
Product Overview
3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole (CAS 854409-25-9), with molecular formula C20H21N3O4S and molecular weight 399.13 g/mol. IUPAC: 5-[1-(benzenesulfonyl)piperidin-4-yl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole.
Chemical Property Profile of 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole
Property Insights of 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole
The XLogP value of 3.3135 indicates that 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole. Following Lipinski's Rule of Five, 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-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 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole?
The CAS number of 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole is 854409-25-9.
What is the molecular formula of 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole?
The molecular formula of 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole is C20H21N3O4S.
What is the molecular weight of 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole?
The molecular weight of 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole is 399.13 g/mol.
Where can I buy 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole?
You can request a quote for 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)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-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methoxyphenyl)-5-(1-(phenylsulfonyl)piperidin-4-yl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.