2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline
TL;DR: 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline (CAS 34952-15-3) is a chemical compound with molecular formula C19H21NO4 and molecular weight 327.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydro-1H-isoquinolin-2-yl-(3,4,5-trimethoxyphenyl)methanone
Also Known As: BAS 01130456, BIM-0000473.P001, 2-(3,4,5-trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline, 3,4-dihydro-1H-isoquinolin-2-yl-(3,4,5-trimethoxyphenyl)methanone, 2-1,2,3,4-tetrahydroisoquinolyl 3,4,5-trimethoxyphenyl ketone
| Molecular Formula | C19H21NO4 |
|---|---|
| Molecular Weight | 327.15 g/mol |
| LogP | 2.9109 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.14706 |
| Heavy Atoms | 24 |
| Complexity | 731.77716 |
Chemical Identifiers
| CAS Number | 34952-15-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC3=CC=CC=C3C2 |
Product Overview
2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline (CAS 34952-15-3), with molecular formula C19H21NO4 and molecular weight 327.15 g/mol. IUPAC: 3,4-dihydro-1H-isoquinolin-2-yl-(3,4,5-trimethoxyphenyl)methanone.
Chemical Property Profile of 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline
Property Insights of 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline
The XLogP value of 2.9109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline. With a topological polar surface area (TPSA) of 48.0 Ų, 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline has 0 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 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline?
The CAS number of 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline is 34952-15-3.
What is the molecular formula of 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline?
The molecular formula of 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline is C19H21NO4.
What is the molecular weight of 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline?
The molecular weight of 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline is 327.15 g/mol.
Where can I buy 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline?
You can request a quote for 2-(3,4,5-Trimethoxybenzoyl)-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 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4,5-Trimethoxybenzoyl)-1,2,3,4-tetrahydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.