Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide
TL;DR: Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide (CAS 64070-80-0) is a chemical compound with molecular formula C15H25IN2OS and molecular weight 408.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-acetamidophenyl)sulfanylethyl-diethyl-methylazanium iodide
Also Known As: USAF A-12634, N,N-Diethyl-2-(o-acetamidophenylthio)ethylamine methiodide, AMMONIUM, (2-(o-ACETAMIDOPHENYLTHIO)ETHYL)DIETHYLMETHYL-, IODIDE, Ethylamine, N,N-diethyl-2-(o-acetamidophenylthio)-, methiodide, 2-(2-acetamidophenyl)sulfanylethyl-diethyl-methylazanium iodide
| Molecular Formula | C15H25IN2OS |
|---|---|
| Molecular Weight | 408.07 g/mol |
| LogP | 0.23 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 408.07324 |
| Heavy Atoms | 20 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 64070-80-0 |
|---|---|
| SMILES | CC[N+](C)(CC)CCSC1=CC=CC=C1NC(=O)C.[I-] |
| InChIKey | WJCBTRXULGGMSI-UHFFFAOYSA-N |
Product Overview
Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide (CAS 64070-80-0), with molecular formula C15H25IN2OS and molecular weight 408.07 g/mol. IUPAC: 2-(2-acetamidophenyl)sulfanylethyl-diethyl-methylazanium iodide.
Chemical Property Profile of Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide
Property Insights of Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide
The XLogP value of 0.23 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide. With a topological polar surface area (TPSA) of 54.4 Ų, Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide has 1 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 Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide?
The CAS number of Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide is 64070-80-0.
What is the molecular formula of Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide?
The molecular formula of Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide is C15H25IN2OS.
What is the molecular weight of Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide?
The molecular weight of Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide is 408.07 g/mol.
Where can I buy Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide?
You can request a quote for Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (2-(o-acetamidophenylthio)ethyl)diethylmethyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.