N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide
TL;DR: N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide (CAS 903302-80-7) is a chemical compound with molecular formula C20H17N3O5 and molecular weight 379.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide
Also Known As: N-(4-nitrophenyl)-2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamide, F2621-0411, N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide, 2-((2-allyl-1-oxo-1,2-dihydroisoquinolin-5-yl)oxy)-N-(4-nitrophenyl)acetamide
| Molecular Formula | C20H17N3O5 |
|---|---|
| Molecular Weight | 379.12 g/mol |
| LogP | 3.1132 |
| Topological Polar Surface Area | 103.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 379.11682 |
| Heavy Atoms | 28 |
| Complexity | 1103.0194 |
Chemical Identifiers
| CAS Number | 903302-80-7 |
|---|---|
| SMILES | C=CCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide (CAS 903302-80-7), with molecular formula C20H17N3O5 and molecular weight 379.12 g/mol. IUPAC: N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide.
Chemical Property Profile of N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide
Property Insights of N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide
The XLogP value of 3.1132 indicates that N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.47 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide. Following Lipinski's Rule of Five, N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide has 1 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 N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide?
The CAS number of N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide is 903302-80-7.
What is the molecular formula of N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide?
The molecular formula of N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide is C20H17N3O5.
What is the molecular weight of N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide?
The molecular weight of N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide is 379.12 g/mol.
Where can I buy N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide?
You can request a quote for N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-nitrophenyl)-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.