N-Benzyl-N-ethylsulfanilic acid
TL;DR: N-Benzyl-N-ethylsulfanilic acid (CAS 92-56-8) is a chemical compound with molecular formula C15H17NO3S and molecular weight 291.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[benzyl(ethyl)amino]benzenesulfonic acid
Also Known As: N-Benzyl-N-ethylsulfanilic acid, N-Benzyl-N-ethylsulphanil acid, 4-[benzyl(ethyl)amino]benzenesulfonic acid, N-benzyl-N-ethylsulfanilsyre, N-benzyl-N-ethylsulphanilacid
| Molecular Formula | C15H17NO3S |
|---|---|
| Molecular Weight | 291.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.09293 |
| Heavy Atoms | 20 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 92-56-8 |
|---|---|
| SMILES | CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)S(=O)(=O)O |
| InChIKey | OZBLZWHUFCFATD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Benzyl-N-ethylsulfanilic acid (CAS 92-56-8), with molecular formula C15H17NO3S and molecular weight 291.09 g/mol. IUPAC: 4-[benzyl(ethyl)amino]benzenesulfonic acid.
Chemical Property Profile of N-Benzyl-N-ethylsulfanilic acid
Property Insights of N-Benzyl-N-ethylsulfanilic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzyl-N-ethylsulfanilic acid. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Benzyl-N-ethylsulfanilic acid. Following Lipinski's Rule of Five, N-Benzyl-N-ethylsulfanilic acid 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 N-Benzyl-N-ethylsulfanilic acid?
The CAS number of N-Benzyl-N-ethylsulfanilic acid is 92-56-8.
What is the molecular formula of N-Benzyl-N-ethylsulfanilic acid?
The molecular formula of N-Benzyl-N-ethylsulfanilic acid is C15H17NO3S.
What is the molecular weight of N-Benzyl-N-ethylsulfanilic acid?
The molecular weight of N-Benzyl-N-ethylsulfanilic acid is 291.09 g/mol.
Where can I buy N-Benzyl-N-ethylsulfanilic acid?
You can request a quote for N-Benzyl-N-ethylsulfanilic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyl-N-ethylsulfanilic acid?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyl-N-ethylsulfanilic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.