Isoquinolin-2-ium-2-yl(phenyl)azanide
TL;DR: Isoquinolin-2-ium-2-yl(phenyl)azanide (CAS 31382-99-7) is a chemical compound with molecular formula C15H12N2 and molecular weight 220.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
isoquinolin-2-ium-2-yl(phenyl)azanide
Also Known As: isoquinolin-2-ium-2-yl(phenyl)azanide, Isoquinolin-2-yl-phenyl-azanide, N-Phenylisoquinolin-2-ium-2-aminide, N-Phenylisoquinolinium-2-amine anion, Isoquinolinium-2-yl N-phenylamine anion
| Molecular Formula | C15H12N2 |
|---|---|
| Molecular Weight | 220.10 g/mol |
| LogP | 3.5958 |
| Topological Polar Surface Area | 17.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.10005 |
| Heavy Atoms | 17 |
| Complexity | 632.50275 |
Chemical Identifiers
| CAS Number | 31382-99-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)[N-][N+]2=CC3=CC=CC=C3C=C2 |
Product Overview
Isoquinolin-2-ium-2-yl(phenyl)azanide (CAS 31382-99-7), with molecular formula C15H12N2 and molecular weight 220.10 g/mol. IUPAC: isoquinolin-2-ium-2-yl(phenyl)azanide.
Chemical Property Profile of Isoquinolin-2-ium-2-yl(phenyl)azanide
Property Insights of Isoquinolin-2-ium-2-yl(phenyl)azanide
The XLogP value of 3.5958 indicates that Isoquinolin-2-ium-2-yl(phenyl)azanide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.98 Ų, Isoquinolin-2-ium-2-yl(phenyl)azanide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinolin-2-ium-2-yl(phenyl)azanide has 0 hydrogen bond donor(s) and 0 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-2-ium-2-yl(phenyl)azanide?
The CAS number of Isoquinolin-2-ium-2-yl(phenyl)azanide is 31382-99-7.
What is the molecular formula of Isoquinolin-2-ium-2-yl(phenyl)azanide?
The molecular formula of Isoquinolin-2-ium-2-yl(phenyl)azanide is C15H12N2.
What is the molecular weight of Isoquinolin-2-ium-2-yl(phenyl)azanide?
The molecular weight of Isoquinolin-2-ium-2-yl(phenyl)azanide is 220.10 g/mol.
Where can I buy Isoquinolin-2-ium-2-yl(phenyl)azanide?
You can request a quote for Isoquinolin-2-ium-2-yl(phenyl)azanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinolin-2-ium-2-yl(phenyl)azanide?
Yes, KEHONG BIO provides custom synthesis services for Isoquinolin-2-ium-2-yl(phenyl)azanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.