1-Methylquinolinium picrate
TL;DR: 1-Methylquinolinium picrate (CAS 26866-59-1) is a chemical compound with molecular formula C16H12N4O7 and molecular weight 372.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylquinolin-1-ium;2,4,6-trinitrophenolate
Also Known As: 1-methylquinolinium picrate, 1-methylquinolin-1-ium,2,4,6-trinitrophenol, 1-methylquinolin-1-ium; 2,4,6-trinitrophenolate
| Molecular Formula | C16H12N4O7 |
|---|---|
| Molecular Weight | 372.07 g/mol |
| LogP | 2.1491 |
| Topological Polar Surface Area | 164.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 372.0706 |
| Heavy Atoms | 27 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 26866-59-1 |
|---|---|
| SMILES | C[N+]1=CC=CC2=CC=CC=C21.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | JZVTWRSRZHLNRL-UHFFFAOYSA-M |
Product Overview
1-Methylquinolinium picrate (CAS 26866-59-1), with molecular formula C16H12N4O7 and molecular weight 372.07 g/mol. IUPAC: 1-methylquinolin-1-ium;2,4,6-trinitrophenolate.
Chemical Property Profile of 1-Methylquinolinium picrate
Property Insights of 1-Methylquinolinium picrate
The XLogP value of 2.1491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methylquinolinium picrate. The TPSA of 164.0 Ų indicates high polarity, suggesting 1-Methylquinolinium picrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Methylquinolinium picrate has 0 hydrogen bond donor(s) and 7 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 1-Methylquinolinium picrate?
The CAS number of 1-Methylquinolinium picrate is 26866-59-1.
What is the molecular formula of 1-Methylquinolinium picrate?
The molecular formula of 1-Methylquinolinium picrate is C16H12N4O7.
What is the molecular weight of 1-Methylquinolinium picrate?
The molecular weight of 1-Methylquinolinium picrate is 372.07 g/mol.
Where can I buy 1-Methylquinolinium picrate?
You can request a quote for 1-Methylquinolinium picrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylquinolinium picrate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylquinolinium picrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.