4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate
TL;DR: 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate (CAS 24660-41-1) is a chemical compound with molecular formula C14H10N2O2 and molecular weight 238.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-diphenyl-1,3,4-oxadiazol-4-ium-2-olate
Also Known As: 4,5-Diphenylisosydnone, 2,3-Diphenyl-1,3,4-oxadiazol-3-ium-5-olate, 4,5-diphenyl-1,3,4-oxadiazol-4-ium-2-olate, diphenyl-1,3lambda5,4-oxadiazol-3-ylium-5-olate, 4,5-diphenyl-1-oxa-3-aza-4-azoniacyclopenta-2,4-dien-2-olate
| Molecular Formula | C14H10N2O2 |
|---|---|
| Molecular Weight | 238.07 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.07423 |
| Heavy Atoms | 18 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 24660-41-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=[N+](N=C(O2)[O-])C3=CC=CC=C3 |
| InChIKey | MSRFAGAZOMLNMN-UHFFFAOYSA-N |
Product Overview
4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate (CAS 24660-41-1), with molecular formula C14H10N2O2 and molecular weight 238.07 g/mol. IUPAC: 4,5-diphenyl-1,3,4-oxadiazol-4-ium-2-olate.
Chemical Property Profile of 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate
Property Insights of 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate
The XLogP value of 4.4 indicates that 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate 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 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate?
The CAS number of 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate is 24660-41-1.
What is the molecular formula of 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate?
The molecular formula of 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate is C14H10N2O2.
What is the molecular weight of 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate?
The molecular weight of 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate is 238.07 g/mol.
Where can I buy 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate?
You can request a quote for 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Diphenyl-1,3,4-oxadiazol-4-ium-2-olate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.