1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone
TL;DR: 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone (CAS 672275-55-7) is a chemical compound with molecular formula C30H44N2O5 and molecular weight 512.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-(diethylamino)ethanone
Also Known As: 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone, 1-[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-(diethylamino)ethanone, 1-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-(diethylamino)ethanone
| Molecular Formula | C30H44N2O5 |
|---|---|
| Molecular Weight | 512.33 g/mol |
| LogP | 5.2917 |
| Topological Polar Surface Area | 60.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 512.325 |
| Heavy Atoms | 37 |
| Complexity | 1021.2716 |
Chemical Identifiers
| CAS Number | 672275-55-7 |
|---|---|
| SMILES | CCN(CC)CC(=O)N1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OCC)OCC)OCC)OCC |
Product Overview
1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone (CAS 672275-55-7), with molecular formula C30H44N2O5 and molecular weight 512.33 g/mol. IUPAC: 1-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-(diethylamino)ethanone.
Chemical Property Profile of 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone
Property Insights of 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone
The XLogP value of 5.2917 indicates that 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone. Following Lipinski's Rule of Five, 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone 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 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone?
The CAS number of 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone is 672275-55-7.
What is the molecular formula of 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone?
The molecular formula of 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone is C30H44N2O5.
What is the molecular weight of 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone?
The molecular weight of 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone is 512.33 g/mol.
Where can I buy 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone?
You can request a quote for 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diethylamino)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.