4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide
TL;DR: 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide (CAS 79750-01-9) is a chemical compound with molecular formula C9H8N2O3 and molecular weight 192.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2-oxido-3-phenyl-1,2,5-oxadiazol-2-ium
Also Known As: 4-methoxy-3-phenylfuroxan, 3-Phenyl-4-methoxyfurazan 2-oxide, 3-Phenyl-4-methoxy-furazan-2-oxide, 4-methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide, 4-methoxy-2-oxido-3-phenyl-1,2,5-oxadiazol-2-ium
| Molecular Formula | C9H8N2O3 |
|---|---|
| Molecular Weight | 192.05 g/mol |
| LogP | 0.9836 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.0535 |
| Heavy Atoms | 14 |
| Complexity | 424.87704 |
Chemical Identifiers
| CAS Number | 79750-01-9 |
|---|---|
| SMILES | COC1=NO[N+](=C1C2=CC=CC=C2)[O-] |
Product Overview
4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide (CAS 79750-01-9), with molecular formula C9H8N2O3 and molecular weight 192.05 g/mol. IUPAC: 4-methoxy-2-oxido-3-phenyl-1,2,5-oxadiazol-2-ium.
Chemical Property Profile of 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide
Property Insights of 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide
The XLogP value of 0.9836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide. Following Lipinski's Rule of Five, 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide has 0 hydrogen bond donor(s) and 4 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-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide?
The CAS number of 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide is 79750-01-9.
What is the molecular formula of 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide?
The molecular formula of 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide is C9H8N2O3.
What is the molecular weight of 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide?
The molecular weight of 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide is 192.05 g/mol.
Where can I buy 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide?
You can request a quote for 4-Methoxy-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 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-3-phenyl-1,2,5-oxadiazole 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.