N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide
TL;DR: N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide (CAS 702646-76-2) is a chemical compound with molecular formula C20H27NO2S and molecular weight 345.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide
Also Known As: N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide, AQ-390/42698378
| Molecular Formula | C20H27NO2S |
|---|---|
| Molecular Weight | 345.18 g/mol |
| LogP | 4.42164 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.17624 |
| Heavy Atoms | 24 |
| Complexity | 818.70764 |
Chemical Identifiers
| CAS Number | 702646-76-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1C)S(=O)(=O)N(C)CC2=CC=CC=C2)C(C)(C)C |
Product Overview
N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide (CAS 702646-76-2), with molecular formula C20H27NO2S and molecular weight 345.18 g/mol. IUPAC: N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide.
Chemical Property Profile of N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide
Property Insights of N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide
The XLogP value of 4.42164 indicates that N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide has 0 hydrogen bond donor(s) and 2 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-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide?
The CAS number of N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide is 702646-76-2.
What is the molecular formula of N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide?
The molecular formula of N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide is C20H27NO2S.
What is the molecular weight of N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide?
The molecular weight of N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide is 345.18 g/mol.
Where can I buy N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide?
You can request a quote for N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-5-tert-butyl-N,2,3-trimethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.