4-isopropyl-N-methyl-N-phenylbenzenesulfonamide
TL;DR: 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide (CAS 691369-97-8) is a chemical compound with molecular formula C16H19NO2S and molecular weight 289.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-phenyl-4-propan-2-ylbenzenesulfonamide
Also Known As: 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide, N-methyl-N-phenyl-4-propan-2-ylbenzenesulfonamide, AQ-390/42122950
| Molecular Formula | C16H19NO2S |
|---|---|
| Molecular Weight | 289.11 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.11365 |
| Heavy Atoms | 20 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 691369-97-8 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2 |
| InChIKey | KHKFPOIIVHCHRW-UHFFFAOYSA-N |
Product Overview
4-isopropyl-N-methyl-N-phenylbenzenesulfonamide (CAS 691369-97-8), with molecular formula C16H19NO2S and molecular weight 289.11 g/mol. IUPAC: N-methyl-N-phenyl-4-propan-2-ylbenzenesulfonamide.
Chemical Property Profile of 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide
Property Insights of 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide
The XLogP value of 3.8 indicates that 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide has 0 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-isopropyl-N-methyl-N-phenylbenzenesulfonamide?
The CAS number of 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide is 691369-97-8.
What is the molecular formula of 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide?
The molecular formula of 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide is C16H19NO2S.
What is the molecular weight of 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide?
The molecular weight of 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide is 289.11 g/mol.
Where can I buy 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide?
You can request a quote for 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-isopropyl-N-methyl-N-phenylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.