2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate
TL;DR: 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate (CAS 903350-99-2) is a chemical compound with molecular formula C16H17NO4S and molecular weight 319.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-acetamidophenyl) 2,5-dimethylbenzenesulfonate
Also Known As: (2-acetamidophenyl) 2,5-dimethylbenzenesulfonate, 2-acetamidophenyl 2,5-dimethylbenzene-1-sulfonate, F3386-5685
| Molecular Formula | C16H17NO4S |
|---|---|
| Molecular Weight | 319.09 g/mol |
| LogP | 3.02954 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.08783 |
| Heavy Atoms | 22 |
| Complexity | 812.64557 |
Chemical Identifiers
| CAS Number | 903350-99-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=CC=C2NC(=O)C |
Product Overview
2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate (CAS 903350-99-2), with molecular formula C16H17NO4S and molecular weight 319.09 g/mol. IUPAC: (2-acetamidophenyl) 2,5-dimethylbenzenesulfonate.
Chemical Property Profile of 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate
Property Insights of 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate
The XLogP value of 3.02954 indicates that 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate. Following Lipinski's Rule of Five, 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate has 1 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 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate?
The CAS number of 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate is 903350-99-2.
What is the molecular formula of 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate?
The molecular formula of 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate is C16H17NO4S.
What is the molecular weight of 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate?
The molecular weight of 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate is 319.09 g/mol.
Where can I buy 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate?
You can request a quote for 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetamidophenyl 2,5-dimethylbenzene-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.