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4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide structure
Fine Chemical

4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide

TL;DR: 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide (CAS 892624-14-5) is a chemical compound with molecular formula C20H19BrN4O2S and molecular weight 458.0412 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide

Also Known As: 4-bromo-N-(1-butyl-1H-pyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide, 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide, 4-bromo-N-[(3E)-1-butyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzenesulfonamide

CAS Number
892624-14-5
Molecular Formula
C20H19BrN4O2S
Molecular Weight
458.0412 g/mol
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Technical Specifications

Molecular FormulaC20H19BrN4O2S
Molecular Weight458.0412 g/mol
XLogP4.7
Topological Polar Surface Area (TPSA)85.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds6
Exact Mass458.0412 Da
Heavy Atoms28
Complexity620.0
SMILESCCCCN1C2=NC3=CC=CC=C3C=C2C(=N1)NS(=O)(=O)C4=CC=C(C=C4)Br
InChIKeyCOLQGQSCQAAUHV-UHFFFAOYSA-N

Chemical Property Profile of 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide

XLogP
4.7
TPSA (Topological Polar Surface Area)
85.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
28
Complexity
620.0
Exact Mass
458.0412
Monoisotopic Mass
458.0412
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-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide

The XLogP value of 4.7 indicates that 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide 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 CAS number of 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide?

The CAS number of 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide is 892624-14-5.

What is the molecular formula of 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide?

The molecular formula of 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide is C20H19BrN4O2S.

What is the molecular weight of 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide?

The molecular weight of 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide is 458.0412 g/mol.

Where can I buy 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide?

You can request a quote for 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide?

Yes, CoreyChem provides custom synthesis services for 4-bromo-N-(1-butylpyrazolo[3,4-b]quinolin-3-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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