![7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide structure](/static/products/3328/332849-90-8.webp)
7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide
TL;DR: 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide (CAS 332849-90-8) is a chemical compound with molecular formula C12H7N5O2 and molecular weight 253.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-oxido-7-phenyltriazolo[4,5-g][2,1,3]benzoxadiazol-6-ium
Also Known As: BAS 01838287, 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide, AJ-292/40487854, 6-oxido-7-phenyltriazolo[4,5-g][2,1,3]benzoxadiazol-6-ium, 7-Phenyl-7H-[1,2,3]triazolo[4',5':3,4]benzo[1,2-c][1,2,5]oxadiazole 6-oxide
| Molecular Formula | C12H7N5O2 |
|---|---|
| Molecular Weight | 253.06 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 82.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.05997 |
| Heavy Atoms | 19 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 332849-90-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2N=C3C(=[N+]2[O-])C=CC4=NON=C43 |
| InChIKey | VMAJSOJQTZGNTQ-UHFFFAOYSA-N |
Product Overview
7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide (CAS 332849-90-8), with molecular formula C12H7N5O2 and molecular weight 253.06 g/mol. IUPAC: 6-oxido-7-phenyltriazolo[4,5-g][2,1,3]benzoxadiazol-6-ium.
Chemical Property Profile of 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide
Property Insights of 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide. The TPSA of 82.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide. Following Lipinski's Rule of Five, 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide has 0 hydrogen bond donor(s) and 5 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 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide?
The CAS number of 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide is 332849-90-8.
What is the molecular formula of 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide?
The molecular formula of 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide is C12H7N5O2.
What is the molecular weight of 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide?
The molecular weight of 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide is 253.06 g/mol.
Where can I buy 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide?
You can request a quote for 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide?
Yes, KEHONG BIO provides custom synthesis services for 7-phenyl-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole 6-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.