4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one
TL;DR: 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one (CAS 874463-47-5) is a chemical compound with molecular formula C17H21N3O4 and molecular weight 331.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,6-dimethylmorpholin-4-yl)-1-ethyl-3-nitroquinolin-2-one
Also Known As: 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one, 4-(2,6-dimethylmorpholin-4-yl)-1-ethyl-3-nitroquinolin-2-one, F3226-3077, 4-(2,6-dimethylmorpholin-4-yl)-1-ethyl-3-nitro-1,2-dihydroquinolin-2-one, 4-(2,6-dimethylmorpholin-4-yl)-1-ethyl-3-nitrohydroquinolin-2-one
| Molecular Formula | C17H21N3O4 |
|---|---|
| Molecular Weight | 331.15 g/mol |
| LogP | 2.5432 |
| Topological Polar Surface Area | 77.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.1532 |
| Heavy Atoms | 24 |
| Complexity | 835.5799 |
Chemical Identifiers
| CAS Number | 874463-47-5 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CC(OC(C3)C)C |
Product Overview
4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one (CAS 874463-47-5), with molecular formula C17H21N3O4 and molecular weight 331.15 g/mol. IUPAC: 4-(2,6-dimethylmorpholin-4-yl)-1-ethyl-3-nitroquinolin-2-one.
Chemical Property Profile of 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one
Property Insights of 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one
The XLogP value of 2.5432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one. The TPSA of 77.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one. Following Lipinski's Rule of Five, 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one has 0 hydrogen bond donor(s) and 5 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 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one?
The CAS number of 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one is 874463-47-5.
What is the molecular formula of 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one?
The molecular formula of 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one is C17H21N3O4.
What is the molecular weight of 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one?
The molecular weight of 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one is 331.15 g/mol.
Where can I buy 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one?
You can request a quote for 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(2,6-dimethylmorpholino)-1-ethyl-3-nitroquinolin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.