(5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
TL;DR: (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone (CAS 672893-86-6) is a chemical compound with molecular formula C32H38ClNO6 and molecular weight 567.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloro-2-methoxyphenyl)-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone
Also Known As: (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone, (5-chloro-2-methoxyphenyl)-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone, (5-chloro-2-methoxyphenyl)[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl]methanone
| Molecular Formula | C32H38ClNO6 |
|---|---|
| Molecular Weight | 567.24 g/mol |
| LogP | 6.9257 |
| Topological Polar Surface Area | 66.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 567.2388 |
| Heavy Atoms | 40 |
| Complexity | 1326.998 |
Chemical Identifiers
| CAS Number | 672893-86-6 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2C(=O)C4=C(C=CC(=C4)Cl)OC)OCC)OCC)OCC |
Product Overview
(5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone (CAS 672893-86-6), with molecular formula C32H38ClNO6 and molecular weight 567.24 g/mol. IUPAC: (5-chloro-2-methoxyphenyl)-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone.
Chemical Property Profile of (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Property Insights of (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
The XLogP value of 6.9257 indicates that (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.46 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone. Following Lipinski's Rule of Five, (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone 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 (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone?
The CAS number of (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone is 672893-86-6.
What is the molecular formula of (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone?
The molecular formula of (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone is C32H38ClNO6.
What is the molecular weight of (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone?
The molecular weight of (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone is 567.24 g/mol.
Where can I buy (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone?
You can request a quote for (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (5-chloro-2-methoxyphenyl)(1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.