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4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one structure
Fine Chemical

4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one

TL;DR: 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one (CAS 115699-71-3) is a chemical compound with molecular formula C14H11ClN2O3S and molecular weight 322.01788 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-(4-chlorophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one

Also Known As: BAS 08978784, 4-(4-chlorophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one, 4-(4-chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one, 4-(4-Chloro-benzenesulfonyl)-3,4-dihydro-1H-quinoxalin-2-one, F1594-0009

CAS Number
115699-71-3
Molecular Formula
C14H11ClN2O3S
Molecular Weight
322.01788 g/mol
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Technical Specifications

Molecular FormulaC14H11ClN2O3S
Molecular Weight322.01788 g/mol
XLogP2.2
Topological Polar Surface Area (TPSA)74.9 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds2
Exact Mass322.01788 Da
Heavy Atoms21
Complexity497.0
SMILESC1C(=O)NC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(C=C3)Cl
InChIKeyDJPSCONZKNJHKI-UHFFFAOYSA-N

Product Description

Applications: 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one (CAS 115699-71-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A fine chemical supplied by CoreyChem, 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one (CAS 115699-71-3) has the molecular formula C14H11ClN2O3S and a molecular weight of 322.02 g/mol. It is also known as BAS 08978784 and 4-(4-chlorophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one.

CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one

XLogP
2.2
TPSA (Topological Polar Surface Area)
74.9
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
2
Heavy Atoms
21
Complexity
497.0
Exact Mass
322.01788
Monoisotopic Mass
322.01788
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 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one

The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one. Following Lipinski's Rule of Five, 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?

The CAS number of 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one is 115699-71-3.

What is the molecular formula of 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?

The molecular formula of 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one is C14H11ClN2O3S.

What is the molecular weight of 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?

The molecular weight of 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one is 322.01788 g/mol.

What are the applications of 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?

4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one (CAS 115699-71-3) with...

Where can I buy 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?

You can request a quote for 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one?

Yes, CoreyChem provides custom synthesis services for 4-(4-Chlorobenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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