![N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide structure](/static/products/761/76102-33-5.png)
N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide
TL;DR: N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide (CAS 76102-33-5) is a chemical compound with molecular formula C22H17N3O4 and molecular weight 387.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-anilino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Also Known As: BAS 00363372, N-[1-(anilinocarbonyl)-2-(3-nitrophenyl)vinyl]benzamide, N-[2-(3-Nitro-phenyl)-1-phenylcarbamoyl-vinyl]-benzamide, N-[(E)-3-anilino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide, (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl)benzamide
| Molecular Formula | C22H17N3O4 |
|---|---|
| Molecular Weight | 387.12 g/mol |
| LogP | 4.0044 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.12192 |
| Heavy Atoms | 29 |
| Complexity | 1063.685 |
Chemical Identifiers
| CAS Number | 76102-33-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)NC3=CC=CC=C3 |
Product Overview
N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide (CAS 76102-33-5), with molecular formula C22H17N3O4 and molecular weight 387.12 g/mol. IUPAC: N-[(E)-3-anilino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide.
Chemical Property Profile of N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide
Property Insights of N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide
The XLogP value of 4.0044 indicates that N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide. Following Lipinski's Rule of Five, N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide has 2 hydrogen bond donor(s) and 4 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-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide?
The CAS number of N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide is 76102-33-5.
What is the molecular formula of N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide?
The molecular formula of N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide is C22H17N3O4.
What is the molecular weight of N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide?
The molecular weight of N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide is 387.12 g/mol.
Where can I buy N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide?
You can request a quote for N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1E)-1-(3-nitrophenyl)-3-oxo-3-(phenylamino)prop-1-en-2-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.