Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate
TL;DR: Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate (CAS 391876-24-7) is a chemical compound with molecular formula C24H19NO3 and molecular weight 369.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[isoquinolin-1-yl(phenyl)methyl] 4-methoxybenzoate
Also Known As: isoquinolylphenylmethyl 4-methoxybenzoate, isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate, AB00714082-01, [isoquinolin-1-yl(phenyl)methyl] 4-methoxybenzoate, F0472-0107
| Molecular Formula | C24H19NO3 |
|---|---|
| Molecular Weight | 369.14 g/mol |
| LogP | 5.1898 |
| Topological Polar Surface Area | 48.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.1365 |
| Heavy Atoms | 28 |
| Complexity | 1086.324 |
Chemical Identifiers
| CAS Number | 391876-24-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)OC(C2=CC=CC=C2)C3=NC=CC4=CC=CC=C43 |
Product Overview
Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate (CAS 391876-24-7), with molecular formula C24H19NO3 and molecular weight 369.14 g/mol. IUPAC: [isoquinolin-1-yl(phenyl)methyl] 4-methoxybenzoate.
Chemical Property Profile of Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate
Property Insights of Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate
The XLogP value of 5.1898 indicates that Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.42 Ų, Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate has 0 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 Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate?
The CAS number of Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate is 391876-24-7.
What is the molecular formula of Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate?
The molecular formula of Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate is C24H19NO3.
What is the molecular weight of Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate?
The molecular weight of Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate is 369.14 g/mol.
Where can I buy Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate?
You can request a quote for Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.