4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole
TL;DR: 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole (CAS 479063-69-9) is a chemical compound with molecular formula C16H22N2OSe and molecular weight 338.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-octoxyphenyl)selenadiazole
Also Known As: 4-(4-octoxyphenyl)selenadiazole, BAS 00126536, 4-(4-(octyloxy)phenyl)-1,2,3-selenadiazole, 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole, 4-(4-Octyloxy-phenyl)-[1,2,3]selenadiazole
| Molecular Formula | C16H22N2OSe |
|---|---|
| Molecular Weight | 338.09 g/mol |
| LogP | 3.9399 |
| Topological Polar Surface Area | 35.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 338.08975 |
| Heavy Atoms | 20 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 479063-69-9 |
|---|---|
| SMILES | CCCCCCCCOC1=CC=C(C=C1)C2=C[Se]N=N2 |
| InChIKey | VIFHCOZHANZPIF-UHFFFAOYSA-N |
Product Overview
4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole (CAS 479063-69-9), with molecular formula C16H22N2OSe and molecular weight 338.09 g/mol. IUPAC: 4-(4-octoxyphenyl)selenadiazole.
Chemical Property Profile of 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole
Property Insights of 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole
The XLogP value of 3.9399 indicates that 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.0 Ų, 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole 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 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole?
The CAS number of 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole is 479063-69-9.
What is the molecular formula of 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole?
The molecular formula of 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole is C16H22N2OSe.
What is the molecular weight of 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole?
The molecular weight of 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole is 338.09 g/mol.
Where can I buy 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole?
You can request a quote for 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Octyloxy-phenyl)-(1,2,3)selenadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.