![N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine structure](/static/products/100/100055-35-4.png)
N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine
TL;DR: N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine (CAS 100055-35-4) is a chemical compound with molecular formula C11H17NO2S and molecular weight 227.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfonyl-N,N-dimethylethanamine
Also Known As: 2-(Benzylsulfonyl)-N,N-dimethyl-ethylamin, 2-benzylsulfonyl-N,N-dimethylethanamine, N-[2-(BENZYLSULFONYL)ETHYL]-N,N-DIMETHYLAMINE, AE-646/31212062
| Molecular Formula | C11H17NO2S |
|---|---|
| Molecular Weight | 227.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.098 |
| Heavy Atoms | 15 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 100055-35-4 |
|---|---|
| SMILES | CN(C)CCS(=O)(=O)CC1=CC=CC=C1 |
| InChIKey | LLILNZAPLWCDPO-UHFFFAOYSA-N |
Product Overview
N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine (CAS 100055-35-4), with molecular formula C11H17NO2S and molecular weight 227.10 g/mol. IUPAC: 2-benzylsulfonyl-N,N-dimethylethanamine.
Chemical Property Profile of N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine
Property Insights of N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine. With a topological polar surface area (TPSA) of 45.8 Ų, N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine has 0 hydrogen bond donor(s) and 3 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-(Benzylsulfonyl)ethyl]-N,N-dimethylamine?
The CAS number of N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine is 100055-35-4.
What is the molecular formula of N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine?
The molecular formula of N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine is C11H17NO2S.
What is the molecular weight of N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine?
The molecular weight of N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine is 227.10 g/mol.
Where can I buy N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine?
You can request a quote for N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(Benzylsulfonyl)ethyl]-N,N-dimethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.