3-Oxo-3-phenylpropionanilide
TL;DR: 3-Oxo-3-phenylpropionanilide (CAS 959-66-0) is a chemical compound with molecular formula C15H13NO2 and molecular weight 239.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxo-N,3-diphenylpropanamide
Also Known As: 2-Benzoylacetanilide, 3-Oxo-N,3-diphenylpropanamide, Benzoylacetanilide, N-Phenylbenzoylacetamide, 3-Oxo-3-phenylpropionanilide
| Molecular Formula | C15H13NO2 |
|---|---|
| Molecular Weight | 239.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.09464 |
| Heavy Atoms | 18 |
| Complexity | 289.0 |
| Solubility | 29.5 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 959-66-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CC(=O)NC2=CC=CC=C2 |
| InChIKey | XRZDIHADHZSFBB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Oxo-3-phenylpropionanilide (CAS 959-66-0), with molecular formula C15H13NO2 and molecular weight 239.09 g/mol. IUPAC: 3-oxo-N,3-diphenylpropanamide.
Chemical Property Profile of 3-Oxo-3-phenylpropionanilide
Property Insights of 3-Oxo-3-phenylpropionanilide
The XLogP value of 3.2 indicates that 3-Oxo-3-phenylpropionanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, 3-Oxo-3-phenylpropionanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Oxo-3-phenylpropionanilide has 1 hydrogen bond donor(s) and 2 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-Oxo-3-phenylpropionanilide?
The CAS number of 3-Oxo-3-phenylpropionanilide is 959-66-0.
What is the molecular formula of 3-Oxo-3-phenylpropionanilide?
The molecular formula of 3-Oxo-3-phenylpropionanilide is C15H13NO2.
What is the molecular weight of 3-Oxo-3-phenylpropionanilide?
The molecular weight of 3-Oxo-3-phenylpropionanilide is 239.09 g/mol.
Where can I buy 3-Oxo-3-phenylpropionanilide?
You can request a quote for 3-Oxo-3-phenylpropionanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Oxo-3-phenylpropionanilide?
Yes, KEHONG BIO provides custom synthesis services for 3-Oxo-3-phenylpropionanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.