4-bromo-3-methyl-N-pentylbenzenesulfonamide
TL;DR: 4-bromo-3-methyl-N-pentylbenzenesulfonamide (CAS 1095829-91-6) is a chemical compound with molecular formula C12H18BrNO2S and molecular weight 319.02417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-3-methyl-N-pentylbenzenesulfonamide
Also Known As: 4-bromo-3-methyl-N-pentylbenzenesulfonamide, A1-44229
Technical Specifications
| Molecular Formula | C12H18BrNO2S |
| Molecular Weight | 319.02417 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.02417 Da |
| Heavy Atoms | 17 |
| Complexity | 313.0 |
| SMILES | CCCCCNS(=O)(=O)C1=CC(=C(C=C1)Br)C |
| InChIKey | VZPKMWBWCKHJRU-UHFFFAOYSA-N |
Chemical Property Profile of 4-bromo-3-methyl-N-pentylbenzenesulfonamide
Property Insights of 4-bromo-3-methyl-N-pentylbenzenesulfonamide
The XLogP value of 3.7 indicates that 4-bromo-3-methyl-N-pentylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, 4-bromo-3-methyl-N-pentylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-3-methyl-N-pentylbenzenesulfonamide 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 4-bromo-3-methyl-N-pentylbenzenesulfonamide?
The CAS number of 4-bromo-3-methyl-N-pentylbenzenesulfonamide is 1095829-91-6.
What is the molecular formula of 4-bromo-3-methyl-N-pentylbenzenesulfonamide?
The molecular formula of 4-bromo-3-methyl-N-pentylbenzenesulfonamide is C12H18BrNO2S.
What is the molecular weight of 4-bromo-3-methyl-N-pentylbenzenesulfonamide?
The molecular weight of 4-bromo-3-methyl-N-pentylbenzenesulfonamide is 319.02417 g/mol.
Where can I buy 4-bromo-3-methyl-N-pentylbenzenesulfonamide?
You can request a quote for 4-bromo-3-methyl-N-pentylbenzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-bromo-3-methyl-N-pentylbenzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for 4-bromo-3-methyl-N-pentylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.