1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine structure

1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine

TL;DR: 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine (CAS 428852-94-2) is a chemical compound with molecular formula C23H23N3O5S and molecular weight 453.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

1-(4-nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine

Also Known As: 1-(4-nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine, 1-[(4-nitrophenyl)sulfonyl]-4-(3-phenoxybenzyl)piperazine, 1-(4-NITROBENZENESULFONYL)-4-[(3-PHENOXYPHENYL)METHYL]PIPERAZINE

CAS: 428852-94-2
Molecular Formula C23H23N3O5S
Molecular Weight 453.14 g/mol
LogP 3.8936
Topological Polar Surface Area 92.99 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 7
Exact Mass 453.13583
Heavy Atoms 32
Complexity 1175.7684

Chemical Identifiers

CAS Number 428852-94-2
SMILES C1CN(CCN1CC2=CC(=CC=C2)OC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Product Overview

1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine (CAS 428852-94-2), with molecular formula C23H23N3O5S and molecular weight 453.14 g/mol. IUPAC: 1-(4-nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine

XLogP
3.8936
TPSA (Topological Polar Surface Area)
92.99
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
7
Heavy Atoms
32
Complexity
1175.7684
Exact Mass
453.13583
Monoisotopic Mass
453.13583
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine

The XLogP value of 3.8936 indicates that 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine. Following Lipinski's Rule of Five, 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine?

The CAS number of 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine is 428852-94-2.

What is the molecular formula of 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine?

The molecular formula of 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine is C23H23N3O5S.

What is the molecular weight of 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine?

The molecular weight of 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine is 453.14 g/mol.

Where can I buy 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine?

You can request a quote for 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]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-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine?

Yes, KEHONG BIO provides custom synthesis services for 1-(4-Nitrophenyl)sulfonyl-4-[(3-phenoxyphenyl)methyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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