1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline
TL;DR: 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline (CAS 28003-40-9) is a chemical compound with molecular formula C19H23NO3 and molecular weight 313.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline
Also Known As: Sid 3752310, 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline, 1-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline, Isoquinoline, 1,2,3,4-tetrahydro-1-((3,4,5-trimethoxyphenyl)methyl)-, (+-)-, (+-)-1,2,3,4-tetrahydro-1-((3,4,5-trimethoxyphenyl)methyl)isoquinoline
| Molecular Formula | C19H23NO3 |
|---|---|
| Molecular Weight | 313.17 g/mol |
| LogP | 3.1419 |
| Topological Polar Surface Area | 39.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.1678 |
| Heavy Atoms | 23 |
| Complexity | 659.0601 |
Chemical Identifiers
| CAS Number | 28003-40-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)CC2C3=CC=CC=C3CCN2 |
Product Overview
1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline (CAS 28003-40-9), with molecular formula C19H23NO3 and molecular weight 313.17 g/mol. IUPAC: 1-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline.
Chemical Property Profile of 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline
Property Insights of 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline
The XLogP value of 3.1419 indicates that 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.72 Ų, 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline has 1 hydrogen bond donor(s) and 4 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 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline?
The CAS number of 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline is 28003-40-9.
What is the molecular formula of 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline?
The molecular formula of 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline is C19H23NO3.
What is the molecular weight of 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline?
The molecular weight of 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline is 313.17 g/mol.
Where can I buy 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline?
You can request a quote for 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.