Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide
TL;DR: Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide (CAS 3947-79-3) is a chemical compound with molecular formula C21H26INO4 and molecular weight 483.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-2-ium iodide
Also Known As: 3,4-Dihydro-6,7-dimethoxy-2-methyl-1-veratrylisoquinolinium iodide, 3,4-dihydro-2-methylnaphthal-1-enyl acetate, ISOQUINOLINIUM, 3,4-DIHYDRO-6,7-DIMETHOXY-2-METHYL-1-VERATRYL-, IODIDE, 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-d, 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-2-ium iodide
| Molecular Formula | C21H26INO4 |
|---|---|
| Molecular Weight | 483.09 g/mol |
| LogP | -0.04 |
| Topological Polar Surface Area | 39.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 483.09067 |
| Heavy Atoms | 27 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 3947-79-3 |
|---|---|
| SMILES | C[N+]1=C(C2=CC(=C(C=C2CC1)OC)OC)CC3=CC(=C(C=C3)OC)OC.[I-] |
| InChIKey | NVQXCYSLJOYHMH-UHFFFAOYSA-M |
Product Overview
Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide (CAS 3947-79-3), with molecular formula C21H26INO4 and molecular weight 483.09 g/mol. IUPAC: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-2-ium iodide.
Chemical Property Profile of Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide
Property Insights of Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide
The XLogP value of -0.04 indicates that Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 39.9 Ų, Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide has 0 hydrogen bond donor(s) and 5 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 Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide?
The CAS number of Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide is 3947-79-3.
What is the molecular formula of Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide?
The molecular formula of Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide is C21H26INO4.
What is the molecular weight of Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide?
The molecular weight of Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide is 483.09 g/mol.
Where can I buy Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide?
You can request a quote for Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Isoquinolinium, 3,4-dihydro-6,7-dimethoxy-2-methyl-1-veratryl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.