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N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide structure
Fine Chemical

N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide

TL;DR: N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide (CAS 1002513-16-7) is a chemical compound with molecular formula C20H13BrN6O2S2 and molecular weight 511.97247 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[3-(3-bromoanilino)quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide

Also Known As: N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide, N-[3-(3-bromoanilino)quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide

CAS Number
1002513-16-7
Molecular Formula
C20H13BrN6O2S2
Molecular Weight
511.97247 g/mol
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Technical Specifications

Molecular FormulaC20H13BrN6O2S2
Molecular Weight511.97247 g/mol
XLogP4.5
Topological Polar Surface Area (TPSA)146.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors9
Rotatable Bonds5
Exact Mass511.97247 Da
Heavy Atoms31
Complexity725.0
SMILESC1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=CC4=NSN=C43)NC5=CC(=CC=C5)Br
InChIKeyYZVQPSAQKFOCOO-UHFFFAOYSA-N

Product Description

Applications: AC1LQGLW is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

AC1LQGLW (CAS 1002513-16-7) is a fine chemical with the molecular formula C20H13BrN6O2S2 and a molecular weight of 511.97 g/mol. Synonyms include N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide and N-[3-(3-bromoanilino)quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide

XLogP
4.5
TPSA (Topological Polar Surface Area)
146.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
9
Rotatable Bonds
5
Heavy Atoms
31
Complexity
725.0
Exact Mass
511.97247
Monoisotopic Mass
511.97247
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 N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide

The XLogP value of 4.5 indicates that N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.0 Ų indicates high polarity, suggesting N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide?

The CAS number of N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide is 1002513-16-7.

What is the molecular formula of N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide?

The molecular formula of N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide is C20H13BrN6O2S2.

What is the molecular weight of N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide?

The molecular weight of N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide is 511.97247 g/mol.

What are the applications of N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide?

AC1LQGLW is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Where can I buy N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide?

You can request a quote for N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide?

Yes, CoreyChem provides custom synthesis services for N-(3-((3-bromophenyl)amino)quinoxalin-2-yl)benzo[c][1,2,5]thiadiazole-4-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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