N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine
TL;DR: N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine (CAS 88738-57-2) is a chemical compound with molecular formula C13H21NOS and molecular weight 239.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfinyl-N,N-diethylethanamine
Also Known As: 2-benzylsulfinyl-N,N-diethylethanamine, 2-Benzylsulfinyl-n,n-diethyl-ethanamine, N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine
| Molecular Formula | C13H21NOS |
|---|---|
| Molecular Weight | 239.13 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 39.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 239.13438 |
| Heavy Atoms | 16 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 88738-57-2 |
|---|---|
| SMILES | CCN(CC)CCS(=O)CC1=CC=CC=C1 |
| InChIKey | SPGWTLAQKZAESN-UHFFFAOYSA-N |
Product Overview
N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine (CAS 88738-57-2), with molecular formula C13H21NOS and molecular weight 239.13 g/mol. IUPAC: 2-benzylsulfinyl-N,N-diethylethanamine.
Chemical Property Profile of N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine
Property Insights of N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine. With a topological polar surface area (TPSA) of 39.5 Ų, N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine 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,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine?
The CAS number of N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine is 88738-57-2.
What is the molecular formula of N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine?
The molecular formula of N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine is C13H21NOS.
What is the molecular weight of N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine?
The molecular weight of N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine is 239.13 g/mol.
Where can I buy N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine?
You can request a quote for N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diethyl-2-(phenylmethanesulfinyl)ethan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.