1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate
TL;DR: 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate (CAS 16421-72-0) is a chemical compound with molecular formula C33H41NO9 and molecular weight 595.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-[4-[2-(4-methoxyphenyl)-1-phenylethyl]phenoxy]ethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: MRL 37 citrate, 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate, 2-(p-(p-Methoxy-alpha-phenylphenethyl)phenoxy)triethylamine citrate, Triethylamine, 2-(p-(p-methoxy-alpha-phenylphenethyl)phenoxy)-, citrate, 2-Hydroxypropane-1,2,3-tricarboxylic acid--N,N-diethyl-2-{4-[2-(4-methoxyphenyl)-1-phenylethyl]phenoxy}ethan-1-amine (1/1)
| Molecular Formula | C33H41NO9 |
|---|---|
| Molecular Weight | 595.28 g/mol |
| LogP | 4.5419 |
| Topological Polar Surface Area | 154.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 16 |
| Exact Mass | 595.27814 |
| Heavy Atoms | 43 |
| Complexity | 658.0 |
Chemical Identifiers
| CAS Number | 16421-72-0 |
|---|---|
| SMILES | CCN(CC)CCOC1=CC=C(C=C1)C(CC2=CC=C(C=C2)OC)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| InChIKey | QBYOGPBYQJZPHY-UHFFFAOYSA-N |
Product Overview
1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate (CAS 16421-72-0), with molecular formula C33H41NO9 and molecular weight 595.28 g/mol. IUPAC: N,N-diethyl-2-[4-[2-(4-methoxyphenyl)-1-phenylethyl]phenoxy]ethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid.
Chemical Property Profile of 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate
Property Insights of 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate
The XLogP value of 4.5419 indicates that 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 154.0 Ų indicates high polarity, suggesting 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate?
The CAS number of 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate is 16421-72-0.
What is the molecular formula of 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate?
The molecular formula of 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate is C33H41NO9.
What is the molecular weight of 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate?
The molecular weight of 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate is 595.28 g/mol.
Where can I buy 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate?
You can request a quote for 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate?
Yes, KEHONG BIO provides custom synthesis services for 1-(p-(2-Diethylaminoethoxy)phenyl)-2-(p-methoxyphenyl)-1-phenylethane citrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.