3'-Acetyl-N-methyl-P-toluenesulfonanilide
TL;DR: 3'-Acetyl-N-methyl-P-toluenesulfonanilide (CAS 60726-00-3) is a chemical compound with molecular formula C16H17NO3S and molecular weight 303.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-acetylphenyl)-N,4-dimethylbenzenesulfonamide
Also Known As: 3'-ACETYL-N-METHYL-P-TOLUENESULFONANILIDE, n-(3-acetylphenyl)-n,4-dimethylbenzenesulfonamide, N-(3-acetylphenyl)-N,4-dimethyl-benzenesulfonamide, N-(3-Acetylphenyl)-N,4-dimethylbenzene-1-sulfonamide
| Molecular Formula | C16H17NO3S |
|---|---|
| Molecular Weight | 303.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.09293 |
| Heavy Atoms | 21 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 60726-00-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC(=C2)C(=O)C |
| InChIKey | NGQLIMCNYHEETR-UHFFFAOYSA-N |
Product Overview
3'-Acetyl-N-methyl-P-toluenesulfonanilide (CAS 60726-00-3), with molecular formula C16H17NO3S and molecular weight 303.09 g/mol. IUPAC: N-(3-acetylphenyl)-N,4-dimethylbenzenesulfonamide.
Chemical Property Profile of 3'-Acetyl-N-methyl-P-toluenesulfonanilide
Property Insights of 3'-Acetyl-N-methyl-P-toluenesulfonanilide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3'-Acetyl-N-methyl-P-toluenesulfonanilide. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Acetyl-N-methyl-P-toluenesulfonanilide. Following Lipinski's Rule of Five, 3'-Acetyl-N-methyl-P-toluenesulfonanilide 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 3'-Acetyl-N-methyl-P-toluenesulfonanilide?
The CAS number of 3'-Acetyl-N-methyl-P-toluenesulfonanilide is 60726-00-3.
What is the molecular formula of 3'-Acetyl-N-methyl-P-toluenesulfonanilide?
The molecular formula of 3'-Acetyl-N-methyl-P-toluenesulfonanilide is C16H17NO3S.
What is the molecular weight of 3'-Acetyl-N-methyl-P-toluenesulfonanilide?
The molecular weight of 3'-Acetyl-N-methyl-P-toluenesulfonanilide is 303.09 g/mol.
Where can I buy 3'-Acetyl-N-methyl-P-toluenesulfonanilide?
You can request a quote for 3'-Acetyl-N-methyl-P-toluenesulfonanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Acetyl-N-methyl-P-toluenesulfonanilide?
Yes, KEHONG BIO provides custom synthesis services for 3'-Acetyl-N-methyl-P-toluenesulfonanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.