![4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole structure](/static/products/5225/522598-20-5.webp)
4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole
TL;DR: 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole (CAS 522598-20-5) is a chemical compound with molecular formula C17H16N6O6S2 and molecular weight 464.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole
Also Known As: 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole, 4,4'-(1,4-diazepane-1,4-diyldisulfonyl)bis(2,1,3-benzoxadiazole), 4-{[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl}-2,1,3-benzoxadiazole, 4-{[4-(benzo[c]1,2,5-oxadiazol-4-ylsulfonyl)-1,4-diazaperhydroepinyl]sulfonyl} benzo[c]1,2,5-oxadiazole
| Molecular Formula | C17H16N6O6S2 |
|---|---|
| Molecular Weight | 464.06 g/mol |
| LogP | 0.8443 |
| Topological Polar Surface Area | 152.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 464.05728 |
| Heavy Atoms | 31 |
| Complexity | 1367.0966 |
Chemical Identifiers
| CAS Number | 522598-20-5 |
|---|---|
| SMILES | C1CN(CCN(C1)S(=O)(=O)C2=CC=CC3=NON=C32)S(=O)(=O)C4=CC=CC5=NON=C54 |
Product Overview
4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole (CAS 522598-20-5), with molecular formula C17H16N6O6S2 and molecular weight 464.06 g/mol. IUPAC: 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole.
Chemical Property Profile of 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole
Property Insights of 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole
The XLogP value of 0.8443 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole. The TPSA of 152.6 Ų indicates high polarity, suggesting 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole has 0 hydrogen bond donor(s) and 10 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-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole?
The CAS number of 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole is 522598-20-5.
What is the molecular formula of 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole?
The molecular formula of 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole is C17H16N6O6S2.
What is the molecular weight of 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole?
The molecular weight of 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole is 464.06 g/mol.
Where can I buy 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole?
You can request a quote for 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-[[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]-2,1,3-benzoxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.