![n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide structure](/static/products/4056/40560-30-3.webp)
n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide
TL;DR: n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide (CAS 40560-30-3) is a chemical compound with molecular formula C11H13N3O2S and molecular weight 251.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,7-diazatricyclo[2.2.1.02,6]heptan-3-yl)benzenesulfonamide
Also Known As: n-(1,7-diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide, N-(1,7-Diazatricyclo[2.2.1.0~2,6~]heptan-3-yl)benzenesulfonamide
| Molecular Formula | C11H13N3O2S |
|---|---|
| Molecular Weight | 251.07 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.07285 |
| Heavy Atoms | 17 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 40560-30-3 |
|---|---|
| SMILES | C1C2C(C3C1N3N2)NS(=O)(=O)C4=CC=CC=C4 |
| InChIKey | VIXIIIKAHMRRBV-UHFFFAOYSA-N |
Product Overview
n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide (CAS 40560-30-3), with molecular formula C11H13N3O2S and molecular weight 251.07 g/mol. IUPAC: N-(1,7-diazatricyclo[2.2.1.02,6]heptan-3-yl)benzenesulfonamide.
Chemical Property Profile of n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide
Property Insights of n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide. Following Lipinski's Rule of Five, n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide has 2 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 n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide?
The CAS number of n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide is 40560-30-3.
What is the molecular formula of n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide?
The molecular formula of n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide is C11H13N3O2S.
What is the molecular weight of n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide?
The molecular weight of n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide is 251.07 g/mol.
Where can I buy n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide?
You can request a quote for n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for n-(1,7-Diazatricyclo[2.2.1.02,6]hept-3-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.