N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine
TL;DR: N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine (CAS 797013-67-3) is a chemical compound with molecular formula C13H20INO2 and molecular weight 349.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-diethoxy-5-iodophenyl)methyl]ethanamine
Also Known As: N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine, N-[(3,4-diethoxy-5-iodophenyl)methyl]ethanamine, AP-970/42525844, [(4,5-diethoxy-3-iodophenyl)methyl]ethylamine
| Molecular Formula | C13H20INO2 |
|---|---|
| Molecular Weight | 349.05 g/mol |
| LogP | 3.1981 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 349.0539 |
| Heavy Atoms | 17 |
| Complexity | 355.51785 |
Chemical Identifiers
| CAS Number | 797013-67-3 |
|---|---|
| SMILES | CCNCC1=CC(=C(C(=C1)I)OCC)OCC |
Product Overview
N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine (CAS 797013-67-3), with molecular formula C13H20INO2 and molecular weight 349.05 g/mol. IUPAC: N-[(3,4-diethoxy-5-iodophenyl)methyl]ethanamine.
Chemical Property Profile of N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine
Property Insights of N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine
The XLogP value of 3.1981 indicates that N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine 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 N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine?
The CAS number of N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine is 797013-67-3.
What is the molecular formula of N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine?
The molecular formula of N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine is C13H20INO2.
What is the molecular weight of N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine?
The molecular weight of N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine is 349.05 g/mol.
Where can I buy N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine?
You can request a quote for N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-diethoxy-5-iodobenzyl)-N-ethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.