4-acetyl-N,N-diethylbenzenesulfonamide
TL;DR: 4-acetyl-N,N-diethylbenzenesulfonamide (CAS 1658-97-5) is a chemical compound with molecular formula C12H17NO3S and molecular weight 255.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-acetyl-N,N-diethylbenzenesulfonamide
Also Known As: 4-acetyl-N,N-diethylbenzenesulfonamide, 4-acetyl-N,N-diethylbenzene-1-sulfonamide, 4-Acetyl-N,N-diethyl-benzenesulfonamide, 4-Diethylsulfamylacetophenone, Benzenesulfonamide, 4-acetyl-N,N-diethyl-
| Molecular Formula | C12H17NO3S |
|---|---|
| Molecular Weight | 255.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.09291 |
| Heavy Atoms | 17 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 1658-97-5 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)C |
| InChIKey | OKAAHYQTIYWBEL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-acetyl-N,N-diethylbenzenesulfonamide (CAS 1658-97-5), with molecular formula C12H17NO3S and molecular weight 255.09 g/mol. IUPAC: 4-acetyl-N,N-diethylbenzenesulfonamide.
Chemical Property Profile of 4-acetyl-N,N-diethylbenzenesulfonamide
Property Insights of 4-acetyl-N,N-diethylbenzenesulfonamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-acetyl-N,N-diethylbenzenesulfonamide. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-acetyl-N,N-diethylbenzenesulfonamide. Following Lipinski's Rule of Five, 4-acetyl-N,N-diethylbenzenesulfonamide has 0 hydrogen bond donor(s) and 4 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-acetyl-N,N-diethylbenzenesulfonamide?
The CAS number of 4-acetyl-N,N-diethylbenzenesulfonamide is 1658-97-5.
What is the molecular formula of 4-acetyl-N,N-diethylbenzenesulfonamide?
The molecular formula of 4-acetyl-N,N-diethylbenzenesulfonamide is C12H17NO3S.
What is the molecular weight of 4-acetyl-N,N-diethylbenzenesulfonamide?
The molecular weight of 4-acetyl-N,N-diethylbenzenesulfonamide is 255.09 g/mol.
Where can I buy 4-acetyl-N,N-diethylbenzenesulfonamide?
You can request a quote for 4-acetyl-N,N-diethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-acetyl-N,N-diethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-acetyl-N,N-diethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.