4-Bromo-N-isopropylbenzenesulphonamide
TL;DR: 4-Bromo-N-isopropylbenzenesulphonamide (CAS 1984-27-6) is a chemical compound with molecular formula C9H12BrNO2S and molecular weight 276.9772 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-N-propan-2-ylbenzenesulfonamide
Also Known As: 4-bromo-n-isopropylbenzenesulfonamide, N-Isopropyl 4-bromobenzenesulfonamide, 4-Bromo-N-isopropylbenzenesulphonamide, 4-bromo-N-propan-2-ylbenzenesulfonamide, p-Bromo-N-isopropylbenzenesulfonamide
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H12BrNO2S |
| Molecular Weight | 276.9772 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.9772 Da |
| Heavy Atoms | 14 |
| Complexity | 263.0 |
| SMILES | CC(C)NS(=O)(=O)C1=CC=C(C=C1)Br |
| InChIKey | WQHMEBIEXOFZHD-UHFFFAOYSA-N |
Chemical Property Profile of 4-Bromo-N-isopropylbenzenesulphonamide
Property Insights of 4-Bromo-N-isopropylbenzenesulphonamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-N-isopropylbenzenesulphonamide. With a topological polar surface area (TPSA) of 54.6 Ų, 4-Bromo-N-isopropylbenzenesulphonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-N-isopropylbenzenesulphonamide 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-N-isopropylbenzenesulphonamide?
The CAS number of 4-Bromo-N-isopropylbenzenesulphonamide is 1984-27-6.
What is the molecular formula of 4-Bromo-N-isopropylbenzenesulphonamide?
The molecular formula of 4-Bromo-N-isopropylbenzenesulphonamide is C9H12BrNO2S.
What is the molecular weight of 4-Bromo-N-isopropylbenzenesulphonamide?
The molecular weight of 4-Bromo-N-isopropylbenzenesulphonamide is 276.9772 g/mol.
Where can I buy 4-Bromo-N-isopropylbenzenesulphonamide?
You can request a quote for 4-Bromo-N-isopropylbenzenesulphonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Bromo-N-isopropylbenzenesulphonamide?
Yes, CoreyChem provides custom synthesis services for 4-Bromo-N-isopropylbenzenesulphonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.