1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine structure

1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine

TL;DR: 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine (CAS 696623-74-2) is a chemical compound with molecular formula C22H28N2O6S and molecular weight 448.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

1-(1,3-benzodioxol-5-ylmethyl)-4-(2,5-diethoxyphenyl)sulfonylpiperazine

Also Known As: BAS 10302871, 1-(1,3-benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine, AP-263/43028346, 1-(1,3-benzodioxol-5-ylmethyl)-4-(2,5-diethoxyphenyl)sulfonylpiperazine, A3586/0152130

CAS: 696623-74-2
Molecular Formula C22H28N2O6S
Molecular Weight 448.17 g/mol
LogP 2.7192
Topological Polar Surface Area 77.54 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 8
Exact Mass 448.1668
Heavy Atoms 31
Complexity 1018.6564

Chemical Identifiers

CAS Number 696623-74-2
SMILES CCOC1=CC(=C(C=C1)OCC)S(=O)(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Product Overview

1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine (CAS 696623-74-2), with molecular formula C22H28N2O6S and molecular weight 448.17 g/mol. IUPAC: 1-(1,3-benzodioxol-5-ylmethyl)-4-(2,5-diethoxyphenyl)sulfonylpiperazine.

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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-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine

XLogP
2.7192
TPSA (Topological Polar Surface Area)
77.54
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
7
Rotatable Bonds
8
Heavy Atoms
31
Complexity
1018.6564
Exact Mass
448.1668
Monoisotopic Mass
448.1668
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-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine

The XLogP value of 2.7192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine. The TPSA of 77.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]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

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-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine?

The CAS number of 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine is 696623-74-2.

What is the molecular formula of 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine?

The molecular formula of 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine is C22H28N2O6S.

What is the molecular weight of 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine?

The molecular weight of 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine is 448.17 g/mol.

Where can I buy 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine?

You can request a quote for 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine?

Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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