3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one
TL;DR: 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one (CAS 5413-59-2) is a chemical compound with molecular formula C13H14N2O4 and molecular weight 262.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-3-(2-nitrophenyl)piperidine-2,6-dione
Also Known As: o-Nitroglutethimide, 2-Ethyl-2- glutarimide, 2-Ethyl-2-(o-nitrophenyl)glutarimide, 3-ethyl-3-(2-nitrophenyl)piperidine-2,6-dione, 2-o-Nitrophenyl-2-ethylglutarimid
| Molecular Formula | C13H14N2O4 |
|---|---|
| Molecular Weight | 262.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 92.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.09537 |
| Heavy Atoms | 19 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 5413-59-2 |
|---|---|
| SMILES | CCC1(CCC(=O)NC1=O)C2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | FFUZYZRMKNOKJW-UHFFFAOYSA-N |
Product Overview
3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one (CAS 5413-59-2), with molecular formula C13H14N2O4 and molecular weight 262.10 g/mol. IUPAC: 3-ethyl-3-(2-nitrophenyl)piperidine-2,6-dione.
Chemical Property Profile of 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one
Property Insights of 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one. The TPSA of 92.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one. Following Lipinski's Rule of Five, 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one has 1 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 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one?
The CAS number of 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one is 5413-59-2.
What is the molecular formula of 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one?
The molecular formula of 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one is C13H14N2O4.
What is the molecular weight of 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one?
The molecular weight of 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one is 262.10 g/mol.
Where can I buy 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one?
You can request a quote for 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-6-hydroxy-3-(2-nitrophenyl)-4,5-dihydropyridin-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.