4-bromo-N-methylbenzene-1-sulfonamide
TL;DR: 4-bromo-N-methylbenzene-1-sulfonamide (CAS 703-12-8) is a chemical compound with molecular formula C7H8BrNO2S and molecular weight 248.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-methylbenzenesulfonamide
Also Known As: 4-bromo-n-methylbenzenesulfonamide, 4-Bromo-N-methylbenzenesulphonamide, Benzenesulfonamide, p-bromo-N-methyl-, Benzenesulfonamide, 4-bromo-N-methyl-, p-Bromo-N-methylbenzenesulfonamide
| Molecular Formula | C7H8BrNO2S |
|---|---|
| Molecular Weight | 248.95 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.9459 |
| Heavy Atoms | 12 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 703-12-8 |
|---|---|
| SMILES | CNS(=O)(=O)C1=CC=C(C=C1)Br |
| InChIKey | ZAHMEHGOFNLRQN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-bromo-N-methylbenzene-1-sulfonamide (CAS 703-12-8), with molecular formula C7H8BrNO2S and molecular weight 248.95 g/mol. IUPAC: 4-bromo-N-methylbenzenesulfonamide.
Chemical Property Profile of 4-bromo-N-methylbenzene-1-sulfonamide
Property Insights of 4-bromo-N-methylbenzene-1-sulfonamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-N-methylbenzene-1-sulfonamide. With a topological polar surface area (TPSA) of 54.6 Ų, 4-bromo-N-methylbenzene-1-sulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-methylbenzene-1-sulfonamide 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-bromo-N-methylbenzene-1-sulfonamide?
The CAS number of 4-bromo-N-methylbenzene-1-sulfonamide is 703-12-8.
What is the molecular formula of 4-bromo-N-methylbenzene-1-sulfonamide?
The molecular formula of 4-bromo-N-methylbenzene-1-sulfonamide is C7H8BrNO2S.
What is the molecular weight of 4-bromo-N-methylbenzene-1-sulfonamide?
The molecular weight of 4-bromo-N-methylbenzene-1-sulfonamide is 248.95 g/mol.
Where can I buy 4-bromo-N-methylbenzene-1-sulfonamide?
You can request a quote for 4-bromo-N-methylbenzene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-methylbenzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-methylbenzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.