(E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide
TL;DR: (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide (CAS 76102-34-6) is a chemical compound with molecular formula C23H19N3O4 and molecular weight 401.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-(4-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Also Known As: (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide, N-[(1E)-3-[(4-methylphenyl)amino]-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide, N-[(E)-3-(4-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
| Molecular Formula | C23H19N3O4 |
|---|---|
| Molecular Weight | 401.14 g/mol |
| LogP | 4.31282 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.13754 |
| Heavy Atoms | 30 |
| Complexity | 1106.8069 |
Chemical Identifiers
| CAS Number | 76102-34-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/NC(=O)C3=CC=CC=C3 |
Product Overview
(E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide (CAS 76102-34-6), with molecular formula C23H19N3O4 and molecular weight 401.14 g/mol. IUPAC: N-[(E)-3-(4-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide.
Chemical Property Profile of (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide
Property Insights of (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide
The XLogP value of 4.31282 indicates that (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)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 (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide. Following Lipinski's Rule of Five, (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)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 (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide?
The CAS number of (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide is 76102-34-6.
What is the molecular formula of (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide?
The molecular formula of (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide is C23H19N3O4.
What is the molecular weight of (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide?
The molecular weight of (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide is 401.14 g/mol.
Where can I buy (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide?
You can request a quote for (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)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 (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(1-(3-nitrophenyl)-3-oxo-3-(p-tolylamino)prop-1-en-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.