RefChem:350001
TL;DR: RefChem:350001 (CAS 69373-85-9) is a chemical compound with molecular formula C26H36ClNO4 and molecular weight 461.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[3,4-di(propan-2-yloxy)phenyl]methyl]-6,7-diethoxy-3,4-dihydroisoquinoline;hydrochloride
Also Known As: 6,7-Diethoxy-1-(3',4'-diisopropoxybenzyl)-3,4-dihydroisoquinoline hydrochloride, Isoquinoline, 3,4-dihydro-1-((3,4-bis(1-methylethoxy)phenyl)methyl)-6,7-diethoxy-, hydrochloride, 1-({3,4-Bis[(propan-2-yl)oxy]phenyl}methyl)-6,7-diethoxy-3,4-dihydroisoquinoline--hydrogen chloride (1/1), 1-[[3,4-di(propan-2-yloxy)phenyl]methyl]-6,7-diethoxy-3,4-dihydroisoquinoline hydrochloride, RefChem:350001
| Molecular Formula | C26H36ClNO4 |
|---|---|
| Molecular Weight | 461.23 g/mol |
| LogP | 6.0681 |
| Topological Polar Surface Area | 49.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 461.23328 |
| Heavy Atoms | 32 |
| Complexity | 924.28314 |
Chemical Identifiers
| CAS Number | 69373-85-9 |
|---|---|
| SMILES | CCOC1=C(C=C2C(=C1)CCN=C2CC3=CC(=C(C=C3)OC(C)C)OC(C)C)OCC.Cl |
Product Overview
RefChem:350001 (CAS 69373-85-9), with molecular formula C26H36ClNO4 and molecular weight 461.23 g/mol. IUPAC: 1-[[3,4-di(propan-2-yloxy)phenyl]methyl]-6,7-diethoxy-3,4-dihydroisoquinoline;hydrochloride.
Chemical Property Profile of RefChem:350001
Property Insights of RefChem:350001
The XLogP value of 6.0681 indicates that RefChem:350001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.28 Ų, RefChem:350001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:350001 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:350001?
The CAS number of RefChem:350001 is 69373-85-9.
What is the molecular formula of RefChem:350001?
The molecular formula of RefChem:350001 is C26H36ClNO4.
What is the molecular weight of RefChem:350001?
The molecular weight of RefChem:350001 is 461.23 g/mol.
Where can I buy RefChem:350001?
You can request a quote for RefChem:350001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:350001?
Yes, KEHONG BIO provides custom synthesis services for RefChem:350001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.