![4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide structure](/static/products/330/33026-04-9.png)
4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide
TL;DR: 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide (CAS 33026-04-9) is a chemical compound with molecular formula C26H30INO4 and molecular weight 547.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide
Also Known As: 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide, 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol;iodide
| Molecular Formula | C26H30INO4 |
|---|---|
| Molecular Weight | 547.12 g/mol |
| LogP | 1.6057 |
| Topological Polar Surface Area | 58.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 547.12195 |
| Heavy Atoms | 32 |
| Complexity | 1052.6721 |
Chemical Identifiers
| CAS Number | 33026-04-9 |
|---|---|
| SMILES | C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC)OC)CC4=CC=C(C=C4)O.[I-] |
Product Overview
4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide (CAS 33026-04-9), with molecular formula C26H30INO4 and molecular weight 547.12 g/mol. IUPAC: 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide.
Chemical Property Profile of 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide
Property Insights of 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide
The XLogP value of 1.6057 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide. With a topological polar surface area (TPSA) of 58.92 Ų, 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide?
The CAS number of 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide is 33026-04-9.
What is the molecular formula of 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide?
The molecular formula of 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide is C26H30INO4.
What is the molecular weight of 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide?
The molecular weight of 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide is 547.12 g/mol.
Where can I buy 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide?
You can request a quote for 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide?
Yes, KEHONG BIO provides custom synthesis services for 4-[[2-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-1-yl]methyl]phenol iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.