1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine
TL;DR: 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine (CAS 428836-46-8) is a chemical compound with molecular formula C16H17N3O6S2 and molecular weight 411.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine
Also Known As: BAS 03152718, 1-(benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine, 1-[(4-nitrophenyl)sulfonyl]-4-(phenylsulfonyl)piperazine, 1-Benzenesulfonyl-4-(4-nitro-benzenesulfonyl)-piperazine, 4-nitro-1-{[4-(phenylsulfonyl)piperazinyl]sulfonyl}benzene
| Molecular Formula | C16H17N3O6S2 |
|---|---|
| Molecular Weight | 411.06 g/mol |
| LogP | 1.29 |
| Topological Polar Surface Area | 117.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.05588 |
| Heavy Atoms | 27 |
| Complexity | 1029.323 |
Chemical Identifiers
| CAS Number | 428836-46-8 |
|---|---|
| SMILES | C1CN(CCN1S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine (CAS 428836-46-8), with molecular formula C16H17N3O6S2 and molecular weight 411.06 g/mol. IUPAC: 1-(benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine.
Chemical Property Profile of 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine
Property Insights of 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine
The XLogP value of 1.29 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine. The TPSA of 117.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine. Following Lipinski's Rule of Five, 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine 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-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine?
The CAS number of 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine is 428836-46-8.
What is the molecular formula of 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine?
The molecular formula of 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine is C16H17N3O6S2.
What is the molecular weight of 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine?
The molecular weight of 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine is 411.06 g/mol.
Where can I buy 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine?
You can request a quote for 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzenesulfonyl)-4-(4-nitrophenyl)sulfonylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.