N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride
TL;DR: N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride (CAS 79143-65-0) is a chemical compound with molecular formula C18H27ClN2O and molecular weight 322.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-prop-2-ynylazanium chloride
Also Known As: N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride, 2-Propyn-1-aminium, N,N-diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-, chloride, diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-prop-2-ynylazanium chloride, diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-prop-2-ynylazanium,chloride, diethyl-[2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl]-prop-2-ynylazanium chloride
| Molecular Formula | C18H27ClN2O |
|---|---|
| Molecular Weight | 322.18 g/mol |
| LogP | 0.04416 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 322.18118 |
| Heavy Atoms | 22 |
| Complexity | 533.691 |
Chemical Identifiers
| CAS Number | 79143-65-0 |
|---|---|
| SMILES | CC[N+](CC)(CC#C)CC(=O)NC1=C(C=C(C=C1C)C)C.[Cl-] |
Product Overview
N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride (CAS 79143-65-0), with molecular formula C18H27ClN2O and molecular weight 322.18 g/mol. IUPAC: diethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-prop-2-ynylazanium chloride.
Chemical Property Profile of N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride
Property Insights of N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride
The XLogP value of 0.04416 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride. With a topological polar surface area (TPSA) of 29.1 Ų, N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride has 1 hydrogen bond donor(s) and 1 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-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride?
The CAS number of N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride is 79143-65-0.
What is the molecular formula of N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride?
The molecular formula of N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride is C18H27ClN2O.
What is the molecular weight of N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride?
The molecular weight of N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride is 322.18 g/mol.
Where can I buy N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride?
You can request a quote for N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride 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-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diethyl-N-(2-oxo-2-((2,4,6-trimethylphenyl)amino)ethyl)-2-propyn-1-aminium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.