Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate
TL;DR: Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate (CAS 65084-06-2) is a chemical compound with molecular formula C31H41NO6S and molecular weight 555.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3,3-diphenylpropanoyl)-2,6-dimethylphenoxy]ethyl-diethyl-methylazanium;methyl sulfate
Also Known As: Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate, 4'-(2-(N,N-Diethyl-N-methylaminio)ethoxy)-3',5'-dimethyl-diphenylpropiophenone methosulfate, 2-[4-(3,3-diphenylpropanoyl)-2,6-dimethylphenoxy]ethyl-diethyl-methylazanium,methyl sulfate, 2-[4-(3,3-Diphenylpropanoyl)-2,6-dimethylphenoxy]-N,N-diethyl-N-methylethan-1-aminium methyl sulfate, 2-[4-(3,3-diphenylpropanoyl)-2,6-dimethylphenoxy]ethyl-diethyl-methylazanium; methyl sulfate
| Molecular Formula | C31H41NO6S |
|---|---|
| Molecular Weight | 555.27 g/mol |
| LogP | 5.66654 |
| Topological Polar Surface Area | 92.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 555.26544 |
| Heavy Atoms | 39 |
| Complexity | 1226.6643 |
Chemical Identifiers
| CAS Number | 65084-06-2 |
|---|---|
| SMILES | CC[N+](C)(CC)CCOC1=C(C=C(C=C1C)C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C.COS(=O)(=O)[O-] |
Product Overview
Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate (CAS 65084-06-2), with molecular formula C31H41NO6S and molecular weight 555.27 g/mol. IUPAC: 2-[4-(3,3-diphenylpropanoyl)-2,6-dimethylphenoxy]ethyl-diethyl-methylazanium;methyl sulfate.
Chemical Property Profile of Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate
Property Insights of Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate
The XLogP value of 5.66654 indicates that Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate. Following Lipinski's Rule of Five, Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate?
The CAS number of Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate is 65084-06-2.
What is the molecular formula of Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate?
The molecular formula of Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate is C31H41NO6S.
What is the molecular weight of Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate?
The molecular weight of Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate is 555.27 g/mol.
Where can I buy Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate?
You can request a quote for Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate?
Yes, KEHONG BIO provides custom synthesis services for Ethanaminium, 2-N,N-diethyl-2-(2,6-dimethyl-4-(1-oxo-3,3-diphenylpropyl)phenoxy)-N-methyl-, methyl sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.