5-bromo-N-isobutyl-2-methoxybenzenesulfonamide
TL;DR: 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide (CAS 1087639-12-0) is a chemical compound with molecular formula C11H16BrNO3S and molecular weight 321.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-methoxy-N-(2-methylpropyl)benzenesulfonamide
Also Known As: 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide, 5-bromo-2-methoxy-N-(2-methylpropyl)benzenesulfonamide, AP-263/43418953, [(5-bromo-2-methoxyphenyl)sulfonyl](2-methylpropyl)amine
| Molecular Formula | C11H16BrNO3S |
|---|---|
| Molecular Weight | 321.00 g/mol |
| LogP | 2.392 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 321.00342 |
| Heavy Atoms | 17 |
| Complexity | 485.48996 |
Chemical Identifiers
| CAS Number | 1087639-12-0 |
|---|---|
| SMILES | CC(C)CNS(=O)(=O)C1=C(C=CC(=C1)Br)OC |
Product Overview
5-bromo-N-isobutyl-2-methoxybenzenesulfonamide (CAS 1087639-12-0), with molecular formula C11H16BrNO3S and molecular weight 321.00 g/mol. IUPAC: 5-bromo-2-methoxy-N-(2-methylpropyl)benzenesulfonamide.
Chemical Property Profile of 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide
Property Insights of 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide
The XLogP value of 2.392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide. With a topological polar surface area (TPSA) of 55.4 Ų, 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide has 1 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 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide?
The CAS number of 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide is 1087639-12-0.
What is the molecular formula of 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide?
The molecular formula of 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide is C11H16BrNO3S.
What is the molecular weight of 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide?
The molecular weight of 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide is 321.00 g/mol.
Where can I buy 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide?
You can request a quote for 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-N-isobutyl-2-methoxybenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.