(8-Acetamidoisoquinolin-5-yl) acetate
TL;DR: (8-Acetamidoisoquinolin-5-yl) acetate (CAS 7467-74-5) is a chemical compound with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-acetamidoisoquinolin-5-yl) acetate
Also Known As: (8-acetamidoisoquinolin-5-yl) acetate, 8-ACETAMIDOISOQUINOLIN-5-YL ACETATE, ACETAMIDE,N-[5-(ACETYLOXY)-8-ISOQUINOLINYL]-
| Molecular Formula | C13H12N2O3 |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.0848 |
| Heavy Atoms | 18 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 7467-74-5 |
|---|---|
| SMILES | CC(=O)NC1=C2C=NC=CC2=C(C=C1)OC(=O)C |
| InChIKey | NCACIPGQUXOBPV-UHFFFAOYSA-N |
Product Overview
(8-Acetamidoisoquinolin-5-yl) acetate (CAS 7467-74-5), with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol. IUPAC: (8-acetamidoisoquinolin-5-yl) acetate.
Chemical Property Profile of (8-Acetamidoisoquinolin-5-yl) acetate
Property Insights of (8-Acetamidoisoquinolin-5-yl) acetate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (8-Acetamidoisoquinolin-5-yl) acetate. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (8-Acetamidoisoquinolin-5-yl) acetate. Following Lipinski's Rule of Five, (8-Acetamidoisoquinolin-5-yl) acetate has 1 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 (8-Acetamidoisoquinolin-5-yl) acetate?
The CAS number of (8-Acetamidoisoquinolin-5-yl) acetate is 7467-74-5.
What is the molecular formula of (8-Acetamidoisoquinolin-5-yl) acetate?
The molecular formula of (8-Acetamidoisoquinolin-5-yl) acetate is C13H12N2O3.
What is the molecular weight of (8-Acetamidoisoquinolin-5-yl) acetate?
The molecular weight of (8-Acetamidoisoquinolin-5-yl) acetate is 244.08 g/mol.
Where can I buy (8-Acetamidoisoquinolin-5-yl) acetate?
You can request a quote for (8-Acetamidoisoquinolin-5-yl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (8-Acetamidoisoquinolin-5-yl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (8-Acetamidoisoquinolin-5-yl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.