2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline
TL;DR: 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline (CAS 127598-29-2) is a chemical compound with molecular formula C15H10N3O4+ and molecular weight 296.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dinitrophenyl)isoquinolin-2-ium
Also Known As: 2-(2,4-dinitrophenyl)isoquinolin-2-ium, 2-(2,4-Dinitrophenyl)isoquinolinium, 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline, Isoquinolinium, 2-(2,4-dinitrophenyl)-, NCI60_002976
| Molecular Formula | C15H10N3O4+ |
|---|---|
| Molecular Weight | 296.07 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.06714 |
| Heavy Atoms | 22 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 127598-29-2 |
|---|---|
| SMILES | C1=CC=C2C=[N+](C=CC2=C1)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | VOBRDRJWLHTGSG-UHFFFAOYSA-N |
Product Overview
2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline (CAS 127598-29-2), with molecular formula C15H10N3O4+ and molecular weight 296.07 g/mol. IUPAC: 2-(2,4-dinitrophenyl)isoquinolin-2-ium.
Chemical Property Profile of 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline
Property Insights of 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline
The XLogP value of 3.5 indicates that 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline. Following Lipinski's Rule of Five, 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline has 0 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 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline?
The CAS number of 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline is 127598-29-2.
What is the molecular formula of 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline?
The molecular formula of 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline is C15H10N3O4+.
What is the molecular weight of 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline?
The molecular weight of 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline is 296.07 g/mol.
Where can I buy 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline?
You can request a quote for 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-Bis(hydroxy(oxido)amino)phenyl)-2lambda(5)-isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.