![N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine structure](/static/products/127/127876-52-2.png)
N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine
TL;DR: N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine (CAS 127876-52-2) is a chemical compound with molecular formula C17H21NS and molecular weight 271.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-[(2-phenylsulfanylphenyl)methyl]ethanamine
Also Known As: N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine, AE-641/30157046, N-ethyl-N-[(2-phenylsulfanylphenyl)methyl]ethanamine, diethyl-[2-(phenylthio)benzyl]amine;maleic acid, (Z)-2-butenedioic acid;N-ethyl-N-[[2-(phenylthio)phenyl]methyl]ethanamine
| Molecular Formula | C17H21NS |
|---|---|
| Molecular Weight | 271.14 g/mol |
| LogP | 4.6796 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.13947 |
| Heavy Atoms | 19 |
| Complexity | 491.62506 |
Chemical Identifiers
| CAS Number | 127876-52-2 |
|---|---|
| SMILES | CCN(CC)CC1=CC=CC=C1SC2=CC=CC=C2 |
Product Overview
N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine (CAS 127876-52-2), with molecular formula C17H21NS and molecular weight 271.14 g/mol. IUPAC: N-ethyl-N-[(2-phenylsulfanylphenyl)methyl]ethanamine.
Chemical Property Profile of N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine
Property Insights of N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine
The XLogP value of 4.6796 indicates that N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine 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-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine?
The CAS number of N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine is 127876-52-2.
What is the molecular formula of N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine?
The molecular formula of N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine is C17H21NS.
What is the molecular weight of N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine?
The molecular weight of N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine is 271.14 g/mol.
Where can I buy N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine?
You can request a quote for N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.