1-(3-Nitrobenzenesulfonyl)piperazine
TL;DR: 1-(3-Nitrobenzenesulfonyl)piperazine (CAS 89474-78-2) is a chemical compound with molecular formula C10H13N3O4S and molecular weight 271.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-nitrophenyl)sulfonylpiperazine
Also Known As: 1-[(3-nitrophenyl)sulfonyl]piperazine, 1-(3-Nitrobenzenesulfonyl)piperazine, 1-(3-nitrophenyl)sulfonylpiperazine, Piperazine, 1-[(3-nitrophenyl)sulfonyl]-, 1-(3-Nitrophenylsulfonyl)piperazine
| Molecular Formula | C10H13N3O4S |
|---|---|
| Molecular Weight | 271.06 g/mol |
| LogP | 0.1887 |
| Topological Polar Surface Area | 92.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.06268 |
| Heavy Atoms | 18 |
| Complexity | 551.99615 |
Chemical Identifiers
| CAS Number | 89474-78-2 |
|---|---|
| SMILES | C1CN(CCN1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-] |
Product Overview
1-(3-Nitrobenzenesulfonyl)piperazine (CAS 89474-78-2), with molecular formula C10H13N3O4S and molecular weight 271.06 g/mol. IUPAC: 1-(3-nitrophenyl)sulfonylpiperazine.
Chemical Property Profile of 1-(3-Nitrobenzenesulfonyl)piperazine
Property Insights of 1-(3-Nitrobenzenesulfonyl)piperazine
The XLogP value of 0.1887 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Nitrobenzenesulfonyl)piperazine. The TPSA of 92.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Nitrobenzenesulfonyl)piperazine. Following Lipinski's Rule of Five, 1-(3-Nitrobenzenesulfonyl)piperazine has 1 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 1-(3-Nitrobenzenesulfonyl)piperazine?
The CAS number of 1-(3-Nitrobenzenesulfonyl)piperazine is 89474-78-2.
What is the molecular formula of 1-(3-Nitrobenzenesulfonyl)piperazine?
The molecular formula of 1-(3-Nitrobenzenesulfonyl)piperazine is C10H13N3O4S.
What is the molecular weight of 1-(3-Nitrobenzenesulfonyl)piperazine?
The molecular weight of 1-(3-Nitrobenzenesulfonyl)piperazine is 271.06 g/mol.
Where can I buy 1-(3-Nitrobenzenesulfonyl)piperazine?
You can request a quote for 1-(3-Nitrobenzenesulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Nitrobenzenesulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Nitrobenzenesulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.