5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole
TL;DR: 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole (CAS 421583-96-2) is a chemical compound with molecular formula C18H19ClN2O and molecular weight 314.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1-adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole
Also Known As: 5-(1-adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole, AB01312724-01, 5-(ADAMANTAN-1-YL)-3-(4-CHLOROPHENYL)-1,2,4-OXADIAZOLE, 5-Adamantan-1-yl-3-(4-chloro-phenyl)-[1,2,4]oxadiazole, 5-((3r,5r,7r)-adamantan-1-yl)-3-(4-chlorophenyl)-1,2,4-oxadiazole
| Molecular Formula | C18H19ClN2O |
|---|---|
| Molecular Weight | 314.12 g/mol |
| LogP | 4.8578 |
| Topological Polar Surface Area | 38.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.1186 |
| Heavy Atoms | 22 |
| Complexity | 670.84796 |
Chemical Identifiers
| CAS Number | 421583-96-2 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C4=NC(=NO4)C5=CC=C(C=C5)Cl |
Product Overview
5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole (CAS 421583-96-2), with molecular formula C18H19ClN2O and molecular weight 314.12 g/mol. IUPAC: 5-(1-adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole.
Chemical Property Profile of 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole
Property Insights of 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole
The XLogP value of 4.8578 indicates that 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.92 Ų, 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 3 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 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole?
The CAS number of 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole is 421583-96-2.
What is the molecular formula of 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole?
The molecular formula of 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole is C18H19ClN2O.
What is the molecular weight of 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole?
The molecular weight of 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole is 314.12 g/mol.
Where can I buy 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole?
You can request a quote for 5-(1-Adamantyl)-3-(4-chlorophenyl)-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 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(1-Adamantyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.