![N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide structure](/static/products/4310/431069-06-6.webp)
N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
TL;DR: N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide (CAS 431069-06-6) is a chemical compound with molecular formula C16H12BrN3O4 and molecular weight 389.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
Also Known As: AB00114562-01, N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide, N-[(1E)-1-carbamoyl-2-(3-nitrophenyl)vinyl](4-bromophenyl)carboxamide, N-[(1E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
| Molecular Formula | C16H12BrN3O4 |
|---|---|
| Molecular Weight | 389.00 g/mol |
| LogP | 2.6135 |
| Topological Polar Surface Area | 115.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.00113 |
| Heavy Atoms | 24 |
| Complexity | 831.47107 |
Chemical Identifiers
| CAS Number | 431069-06-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])/C=C(\C(=O)N)/NC(=O)C2=CC=C(C=C2)Br |
Product Overview
N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide (CAS 431069-06-6), with molecular formula C16H12BrN3O4 and molecular weight 389.00 g/mol. IUPAC: N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide.
Chemical Property Profile of N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
Property Insights of N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
The XLogP value of 2.6135 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide. The TPSA of 115.33 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide. Following Lipinski's Rule of Five, N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide 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-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide?
The CAS number of N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide is 431069-06-6.
What is the molecular formula of N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide?
The molecular formula of N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide is C16H12BrN3O4.
What is the molecular weight of N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide?
The molecular weight of N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide is 389.00 g/mol.
Where can I buy N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide?
You can request a quote for N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-3-amino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-bromobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.