Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt
TL;DR: Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt (CAS 59804-88-5) is a chemical compound with molecular formula C15H11NO2 and molecular weight 237.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methylpyridin-1-ium-3-yl)-3-oxoinden-1-olate
Also Known As: Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt, 2-(1-methylpyridin-1-ium-3-yl)-3-oxoinden-1-olate, 2-(1-Methylpyridin-1-ium-3-yl)-1-oxo-1H-inden-3-olate
| Molecular Formula | C15H11NO2 |
|---|---|
| Molecular Weight | 237.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 44.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.07898 |
| Heavy Atoms | 18 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 59804-88-5 |
|---|---|
| SMILES | C[N+]1=CC=CC(=C1)C2=C(C3=CC=CC=C3C2=O)[O-] |
| InChIKey | HPAOBGVQQBQKOC-UHFFFAOYSA-N |
Product Overview
Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt (CAS 59804-88-5), with molecular formula C15H11NO2 and molecular weight 237.08 g/mol. IUPAC: 2-(1-methylpyridin-1-ium-3-yl)-3-oxoinden-1-olate.
Chemical Property Profile of Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt
Property Insights of Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt. With a topological polar surface area (TPSA) of 44.0 Ų, Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt has 0 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 Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt?
The CAS number of Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt is 59804-88-5.
What is the molecular formula of Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt?
The molecular formula of Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt is C15H11NO2.
What is the molecular weight of Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt?
The molecular weight of Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt is 237.08 g/mol.
Where can I buy Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt?
You can request a quote for Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 3-(1,3-dihydro-1,3-dioxo-2H-inden-2-yl)-1-methylhydroxide, inner salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.