3-Phenyl-1,2,5-oxadiazole 2-oxide
TL;DR: 3-Phenyl-1,2,5-oxadiazole 2-oxide (CAS 28236-68-2) is a chemical compound with molecular formula C8H6N2O2 and molecular weight 162.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxido-3-phenyl-1,2,5-oxadiazol-2-ium
Also Known As: phenylfuroxan, 3-phenyl-1,2,5-oxadiazole 2-oxide, 2-Oxylato-3-phenylfurazan-2-ium, 2-oxido-3-phenyl-1,2,5-oxadiazol-2-ium, 3-PHENYL-1,2,5-OXADIAZOL-2-IUM-2-OLATE
| Molecular Formula | C8H6N2O2 |
|---|---|
| Molecular Weight | 162.04 g/mol |
| LogP | 0.975 |
| Topological Polar Surface Area | 52.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 162.04292 |
| Heavy Atoms | 12 |
| Complexity | 369.5567 |
Chemical Identifiers
| CAS Number | 28236-68-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=[N+](ON=C2)[O-] |
Product Overview
3-Phenyl-1,2,5-oxadiazole 2-oxide (CAS 28236-68-2), with molecular formula C8H6N2O2 and molecular weight 162.04 g/mol. IUPAC: 2-oxido-3-phenyl-1,2,5-oxadiazol-2-ium.
Chemical Property Profile of 3-Phenyl-1,2,5-oxadiazole 2-oxide
Property Insights of 3-Phenyl-1,2,5-oxadiazole 2-oxide
The XLogP value of 0.975 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenyl-1,2,5-oxadiazole 2-oxide. With a topological polar surface area (TPSA) of 52.97 Ų, 3-Phenyl-1,2,5-oxadiazole 2-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-1,2,5-oxadiazole 2-oxide 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 3-Phenyl-1,2,5-oxadiazole 2-oxide?
The CAS number of 3-Phenyl-1,2,5-oxadiazole 2-oxide is 28236-68-2.
What is the molecular formula of 3-Phenyl-1,2,5-oxadiazole 2-oxide?
The molecular formula of 3-Phenyl-1,2,5-oxadiazole 2-oxide is C8H6N2O2.
What is the molecular weight of 3-Phenyl-1,2,5-oxadiazole 2-oxide?
The molecular weight of 3-Phenyl-1,2,5-oxadiazole 2-oxide is 162.04 g/mol.
Where can I buy 3-Phenyl-1,2,5-oxadiazole 2-oxide?
You can request a quote for 3-Phenyl-1,2,5-oxadiazole 2-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-1,2,5-oxadiazole 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-1,2,5-oxadiazole 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.