1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine
TL;DR: 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine (CAS 694504-74-0) is a chemical compound with molecular formula C18H21N3O7S2 and molecular weight 455.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-ethoxyphenyl)sulfonyl-4-(3-nitrophenyl)sulfonylpiperazine
Also Known As: 1-(4-ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine, F1451-0246, 1-(4-ethoxyphenyl)sulfonyl-4-(3-nitrophenyl)sulfonylpiperazine, 1-((4-ethoxyphenyl)sulfonyl)-4-((3-nitrophenyl)sulfonyl)piperazine, 1-(4-ethoxyphenyl)sulfonyl-4-(3-nitrophenyl)sulfonyl-piperazine
| Molecular Formula | C18H21N3O7S2 |
|---|---|
| Molecular Weight | 455.08 g/mol |
| LogP | 1.6887 |
| Topological Polar Surface Area | 127.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 455.0821 |
| Heavy Atoms | 30 |
| Complexity | 1124.6249 |
Chemical Identifiers
| CAS Number | 694504-74-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-] |
Product Overview
1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine (CAS 694504-74-0), with molecular formula C18H21N3O7S2 and molecular weight 455.08 g/mol. IUPAC: 1-(4-ethoxyphenyl)sulfonyl-4-(3-nitrophenyl)sulfonylpiperazine.
Chemical Property Profile of 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine
Property Insights of 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine
The XLogP value of 1.6887 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine. The TPSA of 127.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine. Following Lipinski's Rule of Five, 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine has 0 hydrogen bond donor(s) and 7 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-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine?
The CAS number of 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine is 694504-74-0.
What is the molecular formula of 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine?
The molecular formula of 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine is C18H21N3O7S2.
What is the molecular weight of 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine?
The molecular weight of 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine is 455.08 g/mol.
Where can I buy 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine?
You can request a quote for 1-(4-Ethoxybenzenesulfonyl)-4-(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-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Ethoxybenzenesulfonyl)-4-(3-nitrobenzenesulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.