5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium
TL;DR: 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium (CAS 6945-17-1) is a chemical compound with molecular formula C16H14N3O2+ and molecular weight 280.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-diphenyloxadiazol-3-ium-5-yl)acetamide
Also Known As: NCIOpen2_002275, 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium, N-(3,4-diphenyloxadiazol-3-ium-5-yl)acetamide
| Molecular Formula | C16H14N3O2+ |
|---|---|
| Molecular Weight | 280.11 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.1086 |
| Heavy Atoms | 21 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 6945-17-1 |
|---|---|
| SMILES | CC(=O)NC1=C([N+](=NO1)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | JWEVPSZRDCOCLP-UHFFFAOYSA-O |
Product Overview
5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium (CAS 6945-17-1), with molecular formula C16H14N3O2+ and molecular weight 280.11 g/mol. IUPAC: N-(3,4-diphenyloxadiazol-3-ium-5-yl)acetamide.
Chemical Property Profile of 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium
Property Insights of 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium
The XLogP value of 3.4 indicates that 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.0 Ų, 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium has 1 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-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium?
The CAS number of 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium is 6945-17-1.
What is the molecular formula of 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium?
The molecular formula of 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium is C16H14N3O2+.
What is the molecular weight of 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium?
The molecular weight of 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium is 280.11 g/mol.
Where can I buy 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium?
You can request a quote for 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetamido-3,4-diphenyl-1,2,3-oxadiazol-3-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.