N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide
TL;DR: N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide (CAS 85475-49-6) is a chemical compound with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide
Also Known As: Oxo-1 1H-isoquinoleine-2 acetamidoxime, 2 -Isoquinolineethanimidamide,N-hydroxy-1-oxo-, N-Hydroxy-1-oxo-2(1H)-isoquinolineethanimidamide, Oxo-1 1H-isoquinoleine-2 acetamidoxime [French], 2(1H)-Isoquinolineethanimidamide, N-hydroxy-1-oxo-
| Molecular Formula | C11H11N3O2 |
|---|---|
| Molecular Weight | 217.09 g/mol |
| LogP | 0.7479 |
| Topological Polar Surface Area | 80.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.08513 |
| Heavy Atoms | 16 |
| Complexity | 601.4463 |
Chemical Identifiers
| CAS Number | 85475-49-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CN(C2=O)C/C(=N\O)/N |
Product Overview
N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide (CAS 85475-49-6), with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol. IUPAC: N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide.
Chemical Property Profile of N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide
Property Insights of N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide
The XLogP value of 0.7479 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide. The TPSA of 80.61 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide. Following Lipinski's Rule of Five, N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide has 2 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 N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide?
The CAS number of N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide is 85475-49-6.
What is the molecular formula of N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide?
The molecular formula of N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide is C11H11N3O2.
What is the molecular weight of N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide?
The molecular weight of N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide is 217.09 g/mol.
Where can I buy N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide?
You can request a quote for N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide?
Yes, KEHONG BIO provides custom synthesis services for N'-hydroxy-2-(1-oxoisoquinolin-2-yl)ethanimidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.