N-benzyl-4-bromo-3-methylbenzenesulfonamide
TL;DR: N-benzyl-4-bromo-3-methylbenzenesulfonamide (CAS 1003740-81-5) is a chemical compound with molecular formula C14H14BrNO2S and molecular weight 338.99286 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-benzyl-4-bromo-3-methylbenzenesulfonamide
Also Known As: N-benzyl-4-bromo-3-methylbenzenesulfonamide, [(4-bromo-3-methylphenyl)sulfonyl]benzylamine, AP-263/41670541
Technical Specifications
| Molecular Formula | C14H14BrNO2S |
| Molecular Weight | 338.99286 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.99286 Da |
| Heavy Atoms | 19 |
| Complexity | 373.0 |
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)NCC2=CC=CC=C2)Br |
| InChIKey | OPHUOYYXVOJLJH-UHFFFAOYSA-N |
Chemical Property Profile of N-benzyl-4-bromo-3-methylbenzenesulfonamide
Property Insights of N-benzyl-4-bromo-3-methylbenzenesulfonamide
The XLogP value of 3.4 indicates that N-benzyl-4-bromo-3-methylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, N-benzyl-4-bromo-3-methylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-4-bromo-3-methylbenzenesulfonamide 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
What is the CAS number of N-benzyl-4-bromo-3-methylbenzenesulfonamide?
The CAS number of N-benzyl-4-bromo-3-methylbenzenesulfonamide is 1003740-81-5.
What is the molecular formula of N-benzyl-4-bromo-3-methylbenzenesulfonamide?
The molecular formula of N-benzyl-4-bromo-3-methylbenzenesulfonamide is C14H14BrNO2S.
What is the molecular weight of N-benzyl-4-bromo-3-methylbenzenesulfonamide?
The molecular weight of N-benzyl-4-bromo-3-methylbenzenesulfonamide is 338.99286 g/mol.
Where can I buy N-benzyl-4-bromo-3-methylbenzenesulfonamide?
You can request a quote for N-benzyl-4-bromo-3-methylbenzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-benzyl-4-bromo-3-methylbenzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for N-benzyl-4-bromo-3-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.