1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine
TL;DR: 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine (CAS 593238-13-2) is a chemical compound with molecular formula C17H26N4O4S and molecular weight 382.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine
Also Known As: 1-ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine, 1-(ethylsulfonyl)-4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazine, 1-(ethylsulfonyl)-4-(4-nitro-3-(piperidin-1-yl)phenyl)piperazine
| Molecular Formula | C17H26N4O4S |
|---|---|
| Molecular Weight | 382.17 g/mol |
| LogP | 2.0568 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.16748 |
| Heavy Atoms | 26 |
| Complexity | 754.0264 |
Chemical Identifiers
| CAS Number | 593238-13-2 |
|---|---|
| SMILES | CCS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])N3CCCCC3 |
Product Overview
1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine (CAS 593238-13-2), with molecular formula C17H26N4O4S and molecular weight 382.17 g/mol. IUPAC: 1-ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine.
Chemical Property Profile of 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine
Property Insights of 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine
The XLogP value of 2.0568 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine. Following Lipinski's Rule of Five, 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine 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-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine?
The CAS number of 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine is 593238-13-2.
What is the molecular formula of 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine?
The molecular formula of 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine is C17H26N4O4S.
What is the molecular weight of 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine?
The molecular weight of 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine is 382.17 g/mol.
Where can I buy 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine?
You can request a quote for 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethylsulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.