![N-[2-(3-oxoprop-1-enyl)phenyl]benzamide structure](/static/products/1272/127280-19-7.webp)
N-[2-(3-oxoprop-1-enyl)phenyl]benzamide
TL;DR: N-[2-(3-oxoprop-1-enyl)phenyl]benzamide (CAS 127280-19-7) is a chemical compound with molecular formula C16H13NO2 and molecular weight 251.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(E)-3-oxoprop-1-enyl]phenyl]benzamide
Also Known As: N-[2-(3-oxoprop-1-enyl)phenyl]benzamide, N-[2-[(E)-3-oxoprop-1-enyl]phenyl]benzamide, N-[2-((1E)-3-oxoprop-1-enyl)phenyl]benzamide, N-{2-[(1E)-3-oxo-1-propenyl]phenyl}benzamide, AE-508/36400005
| Molecular Formula | C16H13NO2 |
|---|---|
| Molecular Weight | 251.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.09464 |
| Heavy Atoms | 19 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 127280-19-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2/C=C/C=O |
| InChIKey | UWKXWRIRYVEEHY-UXBLZVDNSA-N |
Product Overview
N-[2-(3-oxoprop-1-enyl)phenyl]benzamide (CAS 127280-19-7), with molecular formula C16H13NO2 and molecular weight 251.09 g/mol. IUPAC: N-[2-[(E)-3-oxoprop-1-enyl]phenyl]benzamide.
Chemical Property Profile of N-[2-(3-oxoprop-1-enyl)phenyl]benzamide
Property Insights of N-[2-(3-oxoprop-1-enyl)phenyl]benzamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(3-oxoprop-1-enyl)phenyl]benzamide. With a topological polar surface area (TPSA) of 46.2 Ų, N-[2-(3-oxoprop-1-enyl)phenyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(3-oxoprop-1-enyl)phenyl]benzamide 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 N-[2-(3-oxoprop-1-enyl)phenyl]benzamide?
The CAS number of N-[2-(3-oxoprop-1-enyl)phenyl]benzamide is 127280-19-7.
What is the molecular formula of N-[2-(3-oxoprop-1-enyl)phenyl]benzamide?
The molecular formula of N-[2-(3-oxoprop-1-enyl)phenyl]benzamide is C16H13NO2.
What is the molecular weight of N-[2-(3-oxoprop-1-enyl)phenyl]benzamide?
The molecular weight of N-[2-(3-oxoprop-1-enyl)phenyl]benzamide is 251.09 g/mol.
Where can I buy N-[2-(3-oxoprop-1-enyl)phenyl]benzamide?
You can request a quote for N-[2-(3-oxoprop-1-enyl)phenyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(3-oxoprop-1-enyl)phenyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(3-oxoprop-1-enyl)phenyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.