phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate structure

phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate

TL;DR: phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate (CAS 878089-03-3) is a chemical compound with molecular formula C19H19NO5S and molecular weight 373.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate

Also Known As: 2-oxo-2-phenylethyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate, phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate

CAS: 878089-03-3
Molecular Formula C19H19NO5S
Molecular Weight 373.10 g/mol
LogP 2.31122
Topological Polar Surface Area 89.54 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 8
Exact Mass 373.0984
Heavy Atoms 26
Complexity 887.28656

Chemical Identifiers

CAS Number 878089-03-3
SMILES CC1=CC=C(C=C1)/C=C/S(=O)(=O)NCC(=O)OCC(=O)C2=CC=CC=C2

Product Overview

phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate (CAS 878089-03-3), with molecular formula C19H19NO5S and molecular weight 373.10 g/mol. IUPAC: phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate.

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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 phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate

XLogP
2.31122
TPSA (Topological Polar Surface Area)
89.54
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
8
Heavy Atoms
26
Complexity
887.28656
Exact Mass
373.0984
Monoisotopic Mass
373.0984
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 phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate

The XLogP value of 2.31122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate. The TPSA of 89.54 Ų falls within the moderate polarity range, balancing permeability and solubility for phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate. Following Lipinski's Rule of Five, phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate 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

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 phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate?

The CAS number of phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate is 878089-03-3.

What is the molecular formula of phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate?

The molecular formula of phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate is C19H19NO5S.

What is the molecular weight of phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate?

The molecular weight of phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate is 373.10 g/mol.

Where can I buy phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate?

You can request a quote for phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate?

Yes, KEHONG BIO provides custom synthesis services for phenacyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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