![1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane structure](/static/products/838/838869-71-9.png)
1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane
TL;DR: 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane (CAS 838869-71-9) is a chemical compound with molecular formula C17H25N3O3S and molecular weight 351.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-phenylmethanone
Also Known As: 1-[(4-benzoylpiperazin-1-yl)sulfonyl]azepane, BAS 11404238, [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-phenylmethanone, 1-[(4-benzoyl-1-piperazinyl)sulfonyl]azepane, AP-124/43383112
| Molecular Formula | C17H25N3O3S |
|---|---|
| Molecular Weight | 351.16 g/mol |
| LogP | 1.5652 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.16165 |
| Heavy Atoms | 24 |
| Complexity | 646.91815 |
Chemical Identifiers
| CAS Number | 838869-71-9 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3 |
Product Overview
1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane (CAS 838869-71-9), with molecular formula C17H25N3O3S and molecular weight 351.16 g/mol. IUPAC: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-phenylmethanone.
Chemical Property Profile of 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane
Property Insights of 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane
The XLogP value of 1.5652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane. The TPSA of 60.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane. Following Lipinski's Rule of Five, 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane has 0 hydrogen bond donor(s) and 3 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-Benzoylpiperazin-1-yl)sulfonyl]azepane?
The CAS number of 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane is 838869-71-9.
What is the molecular formula of 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane?
The molecular formula of 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane is C17H25N3O3S.
What is the molecular weight of 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane?
The molecular weight of 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane is 351.16 g/mol.
Where can I buy 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane?
You can request a quote for 1-[(4-Benzoylpiperazin-1-yl)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-Benzoylpiperazin-1-yl)sulfonyl]azepane?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Benzoylpiperazin-1-yl)sulfonyl]azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.