![5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide structure](/static/products/159/15944-79-3.png)
5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide
TL;DR: 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide (CAS 15944-79-3) is a chemical compound with molecular formula C6HClN4O3 and molecular weight 211.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-8-oxido-[1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazol-8-ium
Also Known As: 5-chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide, 4-Chloro-8-oxido-[1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazol-8-ium
| Molecular Formula | C6HClN4O3 |
|---|---|
| Molecular Weight | 211.97 g/mol |
| LogP | 0.6508 |
| Topological Polar Surface Area | 91.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 211.97372 |
| Heavy Atoms | 14 |
| Complexity | 630.36127 |
Chemical Identifiers
| CAS Number | 15944-79-3 |
|---|---|
| SMILES | C1=C(C2=NON=C2C3=[N+](ON=C31)[O-])Cl |
Product Overview
5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide (CAS 15944-79-3), with molecular formula C6HClN4O3 and molecular weight 211.97 g/mol. IUPAC: 4-chloro-8-oxido-[1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazol-8-ium.
Chemical Property Profile of 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide
Property Insights of 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide
The XLogP value of 0.6508 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide. The TPSA of 91.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide. Following Lipinski's Rule of Five, 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide has 0 hydrogen bond donor(s) and 6 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 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide?
The CAS number of 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide is 15944-79-3.
What is the molecular formula of 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide?
The molecular formula of 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide is C6HClN4O3.
What is the molecular weight of 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide?
The molecular weight of 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide is 211.97 g/mol.
Where can I buy 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide?
You can request a quote for 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.