4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one
TL;DR: 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one (CAS 874463-39-5) is a chemical compound with molecular formula C13H15N3O4 and molecular weight 277.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-hydroxypropylamino)-1-methyl-3-nitroquinolin-2-one
Also Known As: VU0605812-1, 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one, 4-(2-hydroxypropylamino)-1-methyl-3-nitroquinolin-2-one, F3226-3007, 4-[(2-hydroxypropyl)amino]-1-methyl-3-nitro-1,2-dihydroquinolin-2-one
| Molecular Formula | C13H15N3O4 |
|---|---|
| Molecular Weight | 277.11 g/mol |
| LogP | 1.2394 |
| Topological Polar Surface Area | 97.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.10626 |
| Heavy Atoms | 20 |
| Complexity | 721.3634 |
Chemical Identifiers
| CAS Number | 874463-39-5 |
|---|---|
| SMILES | CC(CNC1=C(C(=O)N(C2=CC=CC=C21)C)[N+](=O)[O-])O |
Product Overview
4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one (CAS 874463-39-5), with molecular formula C13H15N3O4 and molecular weight 277.11 g/mol. IUPAC: 4-(2-hydroxypropylamino)-1-methyl-3-nitroquinolin-2-one.
Chemical Property Profile of 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one
Property Insights of 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one
The XLogP value of 1.2394 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one. The TPSA of 97.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one. Following Lipinski's Rule of Five, 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one has 2 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-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one?
The CAS number of 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one is 874463-39-5.
What is the molecular formula of 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one?
The molecular formula of 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one is C13H15N3O4.
What is the molecular weight of 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one?
The molecular weight of 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one is 277.11 g/mol.
Where can I buy 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one?
You can request a quote for 4-((2-hydroxypropyl)amino)-1-methyl-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-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-((2-hydroxypropyl)amino)-1-methyl-3-nitroquinolin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.