(Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate
TL;DR: (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate (CAS 301341-04-8) is a chemical compound with molecular formula C21H15NO3 and molecular weight 329.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[isoquinolin-1-yl(phenyl)methyl] furan-2-carboxylate
Also Known As: IFLab1_001822, (1-isoquinolyl)phenylmethyl 2-furoate, isoquinolylphenylmethyl furan-2-carboxylate, (isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate, isoquinolin-1-yl(phenyl)methyl furan-2-carboxylate
| Molecular Formula | C21H15NO3 |
|---|---|
| Molecular Weight | 329.11 g/mol |
| LogP | 4.7742 |
| Topological Polar Surface Area | 52.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.1052 |
| Heavy Atoms | 25 |
| Complexity | 988.7826 |
Chemical Identifiers
| CAS Number | 301341-04-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=NC=CC3=CC=CC=C32)OC(=O)C4=CC=CO4 |
Product Overview
(Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate (CAS 301341-04-8), with molecular formula C21H15NO3 and molecular weight 329.11 g/mol. IUPAC: [isoquinolin-1-yl(phenyl)methyl] furan-2-carboxylate.
Chemical Property Profile of (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate
Property Insights of (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate
The XLogP value of 4.7742 indicates that (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.33 Ų, (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate 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 (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate?
The CAS number of (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate is 301341-04-8.
What is the molecular formula of (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate?
The molecular formula of (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate is C21H15NO3.
What is the molecular weight of (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate?
The molecular weight of (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate is 329.11 g/mol.
Where can I buy (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate?
You can request a quote for (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate 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 furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (Isoquinolin-1-yl)(phenyl)methyl furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.