5-Acetamidoisoquinoline
TL;DR: 5-Acetamidoisoquinoline (CAS 27461-33-2) is a chemical compound with molecular formula C11H10N2O and molecular weight 186.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-isoquinolin-5-ylacetamide
Also Known As: 5-ACETAMIDOISOQUINOLINE, N-(Isoquinolin-5-yl)acetamide, N-isoquinolin-5-ylacetamide, N-(5-Isoquinolyl)acetamide, N-(isoquinol-5-yl)acetamide
| Molecular Formula | C11H10N2O |
|---|---|
| Molecular Weight | 186.08 g/mol |
| LogP | 2.1932 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.07932 |
| Heavy Atoms | 14 |
| Complexity | 474.17615 |
Chemical Identifiers
| CAS Number | 27461-33-2 |
|---|---|
| SMILES | CC(=O)NC1=CC=CC2=C1C=CN=C2 |
Product Overview
5-Acetamidoisoquinoline (CAS 27461-33-2), with molecular formula C11H10N2O and molecular weight 186.08 g/mol. IUPAC: N-isoquinolin-5-ylacetamide.
Chemical Property Profile of 5-Acetamidoisoquinoline
Property Insights of 5-Acetamidoisoquinoline
The XLogP value of 2.1932 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetamidoisoquinoline. With a topological polar surface area (TPSA) of 41.99 Ų, 5-Acetamidoisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Acetamidoisoquinoline has 1 hydrogen bond donor(s) and 2 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-Acetamidoisoquinoline?
The CAS number of 5-Acetamidoisoquinoline is 27461-33-2.
What is the molecular formula of 5-Acetamidoisoquinoline?
The molecular formula of 5-Acetamidoisoquinoline is C11H10N2O.
What is the molecular weight of 5-Acetamidoisoquinoline?
The molecular weight of 5-Acetamidoisoquinoline is 186.08 g/mol.
Where can I buy 5-Acetamidoisoquinoline?
You can request a quote for 5-Acetamidoisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetamidoisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetamidoisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.