1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane
TL;DR: 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane (CAS 825607-83-8) is a chemical compound with molecular formula C16H25N3O4S2 and molecular weight 387.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(benzenesulfonyl)piperazin-1-yl]sulfonylazepane
Also Known As: 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane, ASN 10303744, 1-[4-(benzenesulfonyl)piperazin-1-yl]sulfonylazepane, AP-124/43238046, 1-{[4-(phenylsulfonyl)-1-piperazinyl]sulfonyl}azepane
| Molecular Formula | C16H25N3O4S2 |
|---|---|
| Molecular Weight | 387.13 g/mol |
| LogP | 1.1137 |
| Topological Polar Surface Area | 78.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.12866 |
| Heavy Atoms | 25 |
| Complexity | 764.85767 |
Chemical Identifiers
| CAS Number | 825607-83-8 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3 |
Product Overview
1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane (CAS 825607-83-8), with molecular formula C16H25N3O4S2 and molecular weight 387.13 g/mol. IUPAC: 1-[4-(benzenesulfonyl)piperazin-1-yl]sulfonylazepane.
Chemical Property Profile of 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane
Property Insights of 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane
The XLogP value of 1.1137 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane. The TPSA of 78.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane. Following Lipinski's Rule of Five, 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane has 0 hydrogen bond donor(s) and 4 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-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane?
The CAS number of 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane is 825607-83-8.
What is the molecular formula of 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane?
The molecular formula of 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane is C16H25N3O4S2.
What is the molecular weight of 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane?
The molecular weight of 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane is 387.13 g/mol.
Where can I buy 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane?
You can request a quote for 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Benzenesulfonyl-piperazine-1-sulfonyl)-azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.