3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide
TL;DR: 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide (CAS 56132-05-9) is a chemical compound with molecular formula C14H8N4O6 and molecular weight 328.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-bis(3-nitrophenyl)-2-oxido-1,2,5-oxadiazol-2-ium
Also Known As: 3,4-bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide, 3,4-bis(3-nitrophenyl)-2-oxido-1,2,5-oxadiazol-2-ium, 3,4-Bis(3-nitrophenyl)-2-oxo-1,2lambda~5~,5-oxadiazole
| Molecular Formula | C14H8N4O6 |
|---|---|
| Molecular Weight | 328.04 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.04437 |
| Heavy Atoms | 24 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 56132-05-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C2=NO[N+](=C2C3=CC(=CC=C3)[N+](=O)[O-])[O-] |
| InChIKey | ZTKFCKKIGNJNAT-UHFFFAOYSA-N |
Product Overview
3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide (CAS 56132-05-9), with molecular formula C14H8N4O6 and molecular weight 328.04 g/mol. IUPAC: 3,4-bis(3-nitrophenyl)-2-oxido-1,2,5-oxadiazol-2-ium.
Chemical Property Profile of 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide
Property Insights of 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide
The XLogP value of 3.3 indicates that 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 143.0 Ų indicates high polarity, suggesting 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide has 0 hydrogen bond donor(s) and 7 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 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide?
The CAS number of 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide is 56132-05-9.
What is the molecular formula of 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide?
The molecular formula of 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide is C14H8N4O6.
What is the molecular weight of 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide?
The molecular weight of 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide is 328.04 g/mol.
Where can I buy 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide?
You can request a quote for 3,4-Bis(3-nitrophenyl)-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 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Bis(3-nitrophenyl)-1,2,5-oxadiazole 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.