1,1'-(Sulfonyl)bisbenzotriazole
TL;DR: 1,1'-(Sulfonyl)bisbenzotriazole (CAS 89141-80-0) is a chemical compound with molecular formula C12H8N6O2S and molecular weight 300.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzotriazol-1-ylsulfonyl)benzotriazole
Also Known As: sulfonylbis(benzotriazole), 1,1'-(sulfonyl)bisbenzotriazole, 1,1 -Sulfonylbis(1H-benzotriazole), 1-benzotriazol-1-ylsulfonylbenzotriazole, 1-(benzotriazol-1-ylsulfonyl)benzotriazole
| Molecular Formula | C12H8N6O2S |
|---|---|
| Molecular Weight | 300.04 g/mol |
| LogP | 0.8172 |
| Topological Polar Surface Area | 95.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.04294 |
| Heavy Atoms | 21 |
| Complexity | 985.4439 |
Chemical Identifiers
| CAS Number | 89141-80-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2S(=O)(=O)N3C4=CC=CC=C4N=N3 |
Product Overview
1,1'-(Sulfonyl)bisbenzotriazole (CAS 89141-80-0), with molecular formula C12H8N6O2S and molecular weight 300.04 g/mol. IUPAC: 1-(benzotriazol-1-ylsulfonyl)benzotriazole.
Chemical Property Profile of 1,1'-(Sulfonyl)bisbenzotriazole
Property Insights of 1,1'-(Sulfonyl)bisbenzotriazole
The XLogP value of 0.8172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-(Sulfonyl)bisbenzotriazole. The TPSA of 95.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-(Sulfonyl)bisbenzotriazole. Following Lipinski's Rule of Five, 1,1'-(Sulfonyl)bisbenzotriazole 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 1,1'-(Sulfonyl)bisbenzotriazole?
The CAS number of 1,1'-(Sulfonyl)bisbenzotriazole is 89141-80-0.
What is the molecular formula of 1,1'-(Sulfonyl)bisbenzotriazole?
The molecular formula of 1,1'-(Sulfonyl)bisbenzotriazole is C12H8N6O2S.
What is the molecular weight of 1,1'-(Sulfonyl)bisbenzotriazole?
The molecular weight of 1,1'-(Sulfonyl)bisbenzotriazole is 300.04 g/mol.
Where can I buy 1,1'-(Sulfonyl)bisbenzotriazole?
You can request a quote for 1,1'-(Sulfonyl)bisbenzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(Sulfonyl)bisbenzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(Sulfonyl)bisbenzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.