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(benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide structure
Fine Chemical

(benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide

TL;DR: (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide (CAS 1309667-15-9) is a chemical compound with molecular formula C21H16N6O2S2 and molecular weight 448.0776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl]-2,1,3-benzothiadiazole-4-sulfonimidate

Also Known As: (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide, 2,1,3-benzothiadiazol-4-ylsulfonyl-[3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl]azanide

CAS Number
1309667-15-9
Molecular Formula
C21H16N6O2S2
Molecular Weight
448.0776 g/mol
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Technical Specifications

Molecular FormulaC21H16N6O2S2
Molecular Weight448.0776 g/mol
XLogP4.3
Topological Polar Surface Area (TPSA)145.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors8
Rotatable Bonds3
Exact Mass448.0776 Da
Heavy Atoms31
Complexity741.0
SMILESCC1=CC(=C[N+](=C1)C2=NC3=CC=CC=C3N=C2N=S(=O)(C4=CC=CC5=NSN=C54)[O-])C
InChIKeyDTSBCBBZSBSEEC-UHFFFAOYSA-N

Chemical Property Profile of (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide

XLogP
4.3
TPSA (Topological Polar Surface Area)
145.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
8
Rotatable Bonds
3
Heavy Atoms
31
Complexity
741.0
Exact Mass
448.0776
Monoisotopic Mass
448.0776
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 (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide

The XLogP value of 4.3 indicates that (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.0 Ų indicates high polarity, suggesting (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide?

The CAS number of (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide is 1309667-15-9.

What is the molecular formula of (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide?

The molecular formula of (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide is C21H16N6O2S2.

What is the molecular weight of (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide?

The molecular weight of (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide is 448.0776 g/mol.

Where can I buy (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide?

You can request a quote for (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide?

Yes, CoreyChem provides custom synthesis services for (benzo[c][1,2,5]thiadiazol-4-ylsulfonyl)(3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl)amide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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