2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide
TL;DR: 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide (CAS 716342-40-4) is a chemical compound with molecular formula C30H31BrN2O8 and molecular weight 626.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-3,4,5-trimethoxybenzamide
Also Known As: 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide, 2-bromo-N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-3,4,5-trimethoxybenzamide, 2-bromo-N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-3,4,5-trimethoxybenzamide
| Molecular Formula | C30H31BrN2O8 |
|---|---|
| Molecular Weight | 626.13 g/mol |
| LogP | 5.9006 |
| Topological Polar Surface Area | 106.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 626.1264 |
| Heavy Atoms | 41 |
| Complexity | 1591.5436 |
Chemical Identifiers
| CAS Number | 716342-40-4 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NC(=O)C4=CC(=C(C(=C4Br)OC)OC)OC)OC)OC)OC |
Product Overview
2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide (CAS 716342-40-4), with molecular formula C30H31BrN2O8 and molecular weight 626.13 g/mol. IUPAC: 2-bromo-N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-3,4,5-trimethoxybenzamide.
Chemical Property Profile of 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide
Property Insights of 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide
The XLogP value of 5.9006 indicates that 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide. Following Lipinski's Rule of Five, 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide?
The CAS number of 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide is 716342-40-4.
What is the molecular formula of 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide?
The molecular formula of 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide is C30H31BrN2O8.
What is the molecular weight of 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide?
The molecular weight of 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide is 626.13 g/mol.
Where can I buy 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide?
You can request a quote for 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)-3,4,5-trimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.