N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide
TL;DR: N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide (CAS 246236-63-5) is a chemical compound with molecular formula C12H18BrNO2S and molecular weight 319.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide
Also Known As: N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide, N-(2-bromoethyl)-4-tert-butyl-benzenesulfonamide, N1-(2-bromoethyl)-4-(tert-butyl)benzene-1-sulfonamide, N-(2-Bromoethyl)-4-tert-butylbenzene-1-sulfonamide, Benzenesulfonamide, N-(2-bromoethyl)-4-(1,1-dimethylethyl)-
| Molecular Formula | C12H18BrNO2S |
|---|---|
| Molecular Weight | 319.02 g/mol |
| LogP | 2.6573 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.02417 |
| Heavy Atoms | 17 |
| Complexity | 460.27414 |
Chemical Identifiers
| CAS Number | 246236-63-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCBr |
Product Overview
N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide (CAS 246236-63-5), with molecular formula C12H18BrNO2S and molecular weight 319.02 g/mol. IUPAC: N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide.
Chemical Property Profile of N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide
Property Insights of N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide
The XLogP value of 2.6573 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide. With a topological polar surface area (TPSA) of 46.17 Ų, N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide has 1 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-(2-bromoethyl)-4-tert-butylbenzenesulfonamide?
The CAS number of N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide is 246236-63-5.
What is the molecular formula of N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide?
The molecular formula of N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide is C12H18BrNO2S.
What is the molecular weight of N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide?
The molecular weight of N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide is 319.02 g/mol.
Where can I buy N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide?
You can request a quote for N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-bromoethyl)-4-tert-butylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.