Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo-
TL;DR: Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo- (CAS 63134-28-1) is a chemical compound with molecular formula C16H14N2O5 and molecular weight 314.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxyphenyl)-3-(3-nitrophenyl)-3-oxopropanamide
Also Known As: 2-(3-Nitrobenzoyl)-acetic acid-O-anisidide, N-(2-methoxyphenyl)-3-(3-nitrophenyl)-3-oxopropanamide, o-Acetanisidide, 2-(m-nitrobenzoyl)-, Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo-, Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-.beta.-oxo-
| Molecular Formula | C16H14N2O5 |
|---|---|
| Molecular Weight | 314.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.09027 |
| Heavy Atoms | 23 |
| Complexity | 448.0 |
| Solubility | 2.9 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 63134-28-1 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=O)CC(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | GXVZEBWLFFMKMY-UHFFFAOYSA-N |
Product Overview
Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo- (CAS 63134-28-1), with molecular formula C16H14N2O5 and molecular weight 314.09 g/mol. IUPAC: N-(2-methoxyphenyl)-3-(3-nitrophenyl)-3-oxopropanamide.
Chemical Property Profile of Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo-
Property Insights of Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo-
The XLogP value of 3.0 indicates that Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo-. Following Lipinski's Rule of Five, Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo- 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 Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo-?
The CAS number of Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo- is 63134-28-1.
What is the molecular formula of Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo-?
The molecular formula of Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo- is C16H14N2O5.
What is the molecular weight of Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo-?
The molecular weight of Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo- is 314.09 g/mol.
Where can I buy Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo-?
You can request a quote for Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo-?
Yes, KEHONG BIO provides custom synthesis services for Benzenepropanamide, N-(2-methoxyphenyl)-3-nitro-beta-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.