(E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate
TL;DR: (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate (CAS 304877-44-9) is a chemical compound with molecular formula C25H22N2O4 and molecular weight 414.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-2-benzamido-3-(4-methylanilino)-3-oxoprop-1-enyl]phenyl] acetate
Also Known As: (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate, [4-[(E)-2-benzamido-3-(4-methylanilino)-3-oxoprop-1-enyl]phenyl] acetate, 4-{(1E)-3-[(4-methylphenyl)amino]-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenyl acetate
| Molecular Formula | C25H22N2O4 |
|---|---|
| Molecular Weight | 414.16 g/mol |
| LogP | 4.32992 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.15796 |
| Heavy Atoms | 31 |
| Complexity | 1102.5237 |
Chemical Identifiers
| CAS Number | 304877-44-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC=C(C=C2)OC(=O)C)/NC(=O)C3=CC=CC=C3 |
Product Overview
(E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate (CAS 304877-44-9), with molecular formula C25H22N2O4 and molecular weight 414.16 g/mol. IUPAC: [4-[(E)-2-benzamido-3-(4-methylanilino)-3-oxoprop-1-enyl]phenyl] acetate.
Chemical Property Profile of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate
Property Insights of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate
The XLogP value of 4.32992 indicates that (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate. Following Lipinski's Rule of Five, (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate 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)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate?
The CAS number of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate is 304877-44-9.
What is the molecular formula of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate?
The molecular formula of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate is C25H22N2O4.
What is the molecular weight of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate?
The molecular weight of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate is 414.16 g/mol.
Where can I buy (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate?
You can request a quote for (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.