3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide
TL;DR: 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide (CAS 1022831-02-2) is a chemical compound with molecular formula C13H12BrNO3S and molecular weight 340.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide
Also Known As: 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide, AO-854/43447280, 3-bromo-N-(3-hydroxy-4-methyl-phenyl)benzenesulfonamide
| Molecular Formula | C13H12BrNO3S |
|---|---|
| Molecular Weight | 340.97 g/mol |
| LogP | 3.26392 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.97214 |
| Heavy Atoms | 19 |
| Complexity | 713.5783 |
Chemical Identifiers
| CAS Number | 1022831-02-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=CC=C2)Br)O |
Product Overview
3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide (CAS 1022831-02-2), with molecular formula C13H12BrNO3S and molecular weight 340.97 g/mol. IUPAC: 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide.
Chemical Property Profile of 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide
Property Insights of 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide
The XLogP value of 3.26392 indicates that 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide?
The CAS number of 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide is 1022831-02-2.
What is the molecular formula of 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide?
The molecular formula of 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide is C13H12BrNO3S.
What is the molecular weight of 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide?
The molecular weight of 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide is 340.97 g/mol.
Where can I buy 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide?
You can request a quote for 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.