4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide
TL;DR: 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide (CAS 712333-92-1) is a chemical compound with molecular formula C17H18BrFN2O3S and molecular weight 428.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide
Also Known As: 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide, N-(4-bromo-2-fluorophenyl)-4-[methyl(phenylsulfonyl)amino]butanamide
| Molecular Formula | C17H18BrFN2O3S |
|---|---|
| Molecular Weight | 428.02 g/mol |
| LogP | 3.6276 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 428.02054 |
| Heavy Atoms | 25 |
| Complexity | 844.2264 |
Chemical Identifiers
| CAS Number | 712333-92-1 |
|---|---|
| SMILES | CN(CCCC(=O)NC1=C(C=C(C=C1)Br)F)S(=O)(=O)C2=CC=CC=C2 |
Product Overview
4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide (CAS 712333-92-1), with molecular formula C17H18BrFN2O3S and molecular weight 428.02 g/mol. IUPAC: 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide.
Chemical Property Profile of 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide
Property Insights of 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide
The XLogP value of 3.6276 indicates that 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide. Following Lipinski's Rule of Five, 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide 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 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide?
The CAS number of 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide is 712333-92-1.
What is the molecular formula of 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide?
The molecular formula of 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide is C17H18BrFN2O3S.
What is the molecular weight of 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide?
The molecular weight of 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide is 428.02 g/mol.
Where can I buy 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide?
You can request a quote for 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[benzenesulfonyl(methyl)amino]-N-(4-bromo-2-fluorophenyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.