![N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine structure](/static/products/127/127876-52-2.webp)
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 271.13947 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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
Technical Specifications
| Molecular Formula | C17H21NS |
| Molecular Weight | 271.13947 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 28.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.13947 Da |
| Heavy Atoms | 19 |
| Complexity | 233.0 |
| SMILES | CCN(CC)CC1=CC=CC=C1SC2=CC=CC=C2 |
| InChIKey | LWRSLWDTFYXZRF-UHFFFAOYSA-N |
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 4.6 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 28.5 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
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 271.13947 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 CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-ethyl-N-[2-(phenylsulfanyl)benzyl]ethanamine?
Yes, CoreyChem 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.