![5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one structure](/static/products/898/898457-27-7.png)
5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one
TL;DR: 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one (CAS 898457-27-7) is a chemical compound with molecular formula C20H18ClNO3 and molecular weight 355.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(4-chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one
Also Known As: 5-[2-(4-chlorophenyl)-2-oxoethoxy]-2-propyl-1,2-dihydroisoquinolin-1-one, 5-[2-(4-chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one, F2621-0363, 5-(2-(4-chlorophenyl)-2-oxoethoxy)-2-propylisoquinolin-1(2H)-one
| Molecular Formula | C20H18ClNO3 |
|---|---|
| Molecular Weight | 355.10 g/mol |
| LogP | 4.3266 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.09753 |
| Heavy Atoms | 25 |
| Complexity | 960.83234 |
Chemical Identifiers
| CAS Number | 898457-27-7 |
|---|---|
| SMILES | CCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)C3=CC=C(C=C3)Cl |
Product Overview
5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one (CAS 898457-27-7), with molecular formula C20H18ClNO3 and molecular weight 355.10 g/mol. IUPAC: 5-[2-(4-chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one.
Chemical Property Profile of 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one
Property Insights of 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one
The XLogP value of 4.3266 indicates that 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.3 Ų, 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one has 0 hydrogen bond donor(s) and 3 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 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one?
The CAS number of 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one is 898457-27-7.
What is the molecular formula of 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one?
The molecular formula of 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one is C20H18ClNO3.
What is the molecular weight of 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one?
The molecular weight of 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one is 355.10 g/mol.
Where can I buy 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one?
You can request a quote for 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 5-[2-(4-Chlorophenyl)-2-oxoethoxy]-2-propylisoquinolin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.